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Computational Modelling of Control of Laminar Separation Bubble over an Airfoil Using an Integrated Tubercle and Vortex Generator
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作者 MustafaÖzden Sinem Keskin +3 位作者 ErenAnılSezer Muhammed Hatem Mustafa Serdar Genç Halil Hakan Açıkel 《Computer Modeling in Engineering & Sciences》 2026年第2期402-430,共29页
This paper examines a model that combines vortex generators and leading-edge tubercles for controlling the laminar separation bubble(LSB)over an airfoil at low Reynolds numbers(Re).This new concept of passive flow con... This paper examines a model that combines vortex generators and leading-edge tubercles for controlling the laminar separation bubble(LSB)over an airfoil at low Reynolds numbers(Re).This new concept of passive flow control technique utilizing a tubercle and vortex generator(VG)close to the leading edge was analyzed numerically for a NACA0015 airfoil.In this study,the Shear Stress Transport(SST)turbulence model was employed in the numerical modelling.Numerical modelling was completed using the ANSYS-Fluent 18.2 solver.Analyses were conducted to investigate the flow pattern and understand the underlying LSB control phenomena that enabled the new passive flow control method to provide this significant performance benefit.The findings indicated that the new concept of passive flow control technique suppressed the formation of an LSB at the suction surface of the NACA0015 airfoil,resulting in a higher lift coefficient and improved aerodynamic performance.Improvements in LSB dynamics and aerodynamic performance through the passive flow control method lead to increased energy output and enhanced stability. 展开更多
关键词 Laminar separation bubble AIRFOIL tubercle vortex generator flow control
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Ion-cluster-optimized microphase separation in shape-memory polydisulfides for enhanced mechanical performance
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作者 Chengyuan Yu Huiyao Lin +5 位作者 Le Li Ruirui Gu Qi Zhang Chenyu Shi Chenchen Zhang Fei Tong 《Chinese Chemical Letters》 2026年第2期494-500,共7页
Developing advanced polymeric materials with enhanced mechanical properties and functionalities has been a long-standing goal in materials science.Recently,supramolecular polymeric materials(SPMs)have drawn increased ... Developing advanced polymeric materials with enhanced mechanical properties and functionalities has been a long-standing goal in materials science.Recently,supramolecular polymeric materials(SPMs)have drawn increased attention due to their unique properties and potential applications in self-healing,shape memory,sensors,and flexible electronics.Here,we develop an ionic cluster-optimized microphase separation strategy to enhance the toughening and energy dissipation capabilities of polydisulfide-based supramolecular polymers.The mechanical properties,including Young's modulus and toughness,are significantly improved by integrating the quadruple H-bonding 2-ureido-4-pyrimidone(UPy)induced microphase separation with iron(III)-to-carboxylate ionic clusters.By combining established chemical approaches with adjustable polymer phase ratios,it is revealed that the synergistic effect of these factors expands the interchain spacing,facilitates the formation of microphase domains,and enhances the tolerance of polythioctic acid-based polymers to external mechanical and thermal stimuli,meeting the practical requirements for industrial plastic applications.Moreover,the UPy-functionalized polymers incorporating iron carboxylate clusters exhibit good one-way shape memory behavior with practical applicability at a relatively low recovery temperature.Our work demonstrates a novel strategy for constructing industrially viable shape memory dynamic SPMs and paves the way for future innovations in developing SPMs. 展开更多
关键词 Polydisulfides Network toughening lonic clusters Microphase separation Shape-memory supramolecular polymers
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Interpretable machine learning analysis on CO_(2)adsorption and separation capacity of biochar under multi-scenario conditions
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作者 Jialiang Dong Ruikun Wang +5 位作者 Yulong Xie Fuyan Gao ShiTeng Tan Zhenghui Zhao Qianqian Yin Eric J.Hu 《Green Energy & Environment》 2026年第1期131-147,共17页
Biochar has been widely recognized as a promising solid CO_(2)adsorbent with economic and ecological benefits.Industrial CO_(2)emissions originate from diverse sources,while the pore structure and chemical functional ... Biochar has been widely recognized as a promising solid CO_(2)adsorbent with economic and ecological benefits.Industrial CO_(2)emissions originate from diverse sources,while the pore structure and chemical functional groups of biochar exhibit varying degrees of influence on CO_(2)adsorption and separation performance under different adsorption conditions.Therefore,exploring the matching relationship between the physicochemical properties of biochar and its adsorption and separation performance at different adsorption conditions is essential for the development and optimization of carbon-based adsorbents.This study selected the high-performance extreme gradient boosting(XGB)algorithm from various algorithms and utilized it to develop CO_(2),N_(2),CH_(4)adsorption prediction models.Based on this,coupled prediction models were developed for CO_(2)/N_(2)and CO_(2)/CH_(4)adsorption selectivity.Furthermore,feature importance and partial dependence analysis were performed using SHAP values.The results indicate that during CO_(2)adsorption,the influence of the pore structure of biochar outweighs that of its chemical composition.Specifically,the pore structure of 0.4–0.6 nm is the most important property influencing CO_(2)adsorption at low and medium pressure(0–0.6 bar),and the pore structure of 0.6–0.8 nm,as well as the specific surface area contribute the most at high pressure(0.6–1 bar).During CO_(2)selective separation,the CO_(2)/N_(2)mixture is primarily separated through the selective adsorption of CO_(2)by nitrogen functional groups.In contrast,for CO_(2)/CH_(4)mixtures,pore structure<1 nm plays a more critical role in determining adsorption selectivity.In addition,molecular simulation studies further revealed the adsorption filling mechanisms of CO_(2)molecules within different pore sizes and functional groups.Finally,nitrogen-doped biochar was synthesized using de-alkalize lignin as the precursor,KOH as the activating agent,and urea as the nitrogen dopant.CO_(2),N_(2),and CH_(4)isothermal adsorption experiments were conducted,and the experimental results confirmed that the developed prediction models exhibit high accuracy(R^(2)>0.9). 展开更多
关键词 BIOCHAR CO_(2)separation Machine learning Molecular simulation Property-effective relationship
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Three-step formation of diamonds in shock-compressed hydrocarbons:Dissociation,species separation,and nucleation
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作者 Bo Chen Qiyu Zeng +4 位作者 Xiaoxiang Yu Jiahao Chen Shen Zhang Dongdong Kang Jiayu Dai 《Matter and Radiation at Extremes》 2026年第1期58-67,共10页
The accumulation and circulation of carbon and hydrogen contribute to the chemical evolution of ice giant planets.Species separation and diamond precipitation have been reported in carbon-hydrogen systems and have bee... The accumulation and circulation of carbon and hydrogen contribute to the chemical evolution of ice giant planets.Species separation and diamond precipitation have been reported in carbon-hydrogen systems and have been verified by static and shock compression experiments.Nevertheless,the dynamic formation processes underlying these phenomena remain insufficiently understood.In combination with a deep learning model,we demonstrate that diamonds form through a three-step process involving dissociation,species separation,and nucleation processes.Under shock conditions of 125 GPa and 4590 K,hydrocarbons decompose to give hydrogen and low-molecular-weight alkanes(CH_(4) and C_(2)H_(6)),which escape from the carbon chains,resulting in C/H species separation.The remaining carbon atoms without C-H bonds accumulate and nucleate to form diamond crystals.The process of diamond growth is associated with a critical nucleus size at which the dynamic energy barrier plays a key role.These dynamic processes of diamond formation provide insight into the establishment of a model for the evolution of ice giant planets. 展开更多
关键词 diamond formation formation processes ice giant planetsspecies separation DISSOCIATION deep learning modelwe carbon hydrogen static shock compression experimentsneverthelessthe chemical evolution
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Preparation of a homochiral metal-organic cage and its bonded silicas for efficient enantioseparation in high-performance liquid chromatography and gas chromatography
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作者 Jun-Hui Zhang Rui-Xue Liang +5 位作者 Bin Huang Li-Qin Yu Juan Chen Bang-Jin Wang Sheng-Ming Xie Li-Ming Yuan 《Chinese Chemical Letters》 2026年第1期520-526,共7页
Developing a chiral material as versatile and universal chiral stationary phase(CSP) for chiral separation in diverse chromatographic techniques simultaneously is of great significance.In this study,we demonstrated fo... Developing a chiral material as versatile and universal chiral stationary phase(CSP) for chiral separation in diverse chromatographic techniques simultaneously is of great significance.In this study,we demonstrated for the first time that a chiral metal-organic cage(MOC),[Zn_(6)M_(4)],as a universal chiral recognition material for both multi-mode high-performance liquid chromatography(HPLC) and capillary gas chromatography(GC) enantioseparation.Two novel HPLC CSPs with different bonding arms(CSP-A with a cationic imidazolium bonding arm and CSP-B with an alkyl chain bonding arm) were prepared by clicking of functionalized chiral MOC [Zn_(6)M_(4)] onto thiolated silica via thiol-ene click chemistry.Meanwhile,a capillary GC column statically coated with the chiral MOC [Zn_(6)M_(4)] was also fabricated.The results showed that the chiral MOC exhibits excellent enantioselectivity not only in normal phase HPLC(NP-HPLC) and reversed phase(RP-HPLC) but also in GC,and various racemates were well separated,including alcohols,diols,esters,ketones,ethers,amines,and epoxides.Importantly,CSP-A and CSP-B are complementary to commercially available Chiralcel OD-H and Chiralpak AD-H columns in enantioseparation,which can separate some racemates that could not be or could not well be separated by the two widely used commercial columns,suggesting the great potential of the two prepared CSPs in enantioseparation.This work reveals that the chiral MOC is potential versatile chiral recognition materials for both HPLC and GC,and also paves the way to expand the potential applications of MOCs. 展开更多
关键词 Chiral metal-organic cage Chiral stationary phase Chiral separation High-performance liquid chromatography Gas chromatography
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COF Scaffold Membrane with Gate-Lane Nanostructure for Efficient Li^(+)/Mg^(2+) Separation
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作者 Zixuan Zhang Yan Kong +6 位作者 Runlai Li Xiaolin Yue Hao Deng Yu Zheng Sui Zhang Runnan Zhang Zhongyi Jiang 《Nano-Micro Letters》 2026年第4期550-563,共14页
Due to complex ion-ion and ion-membrane interactions, creating innovative membrane structures to acquire favorable ion mixing effect and high separation performance remains a big challenge. Herein, we design covalent ... Due to complex ion-ion and ion-membrane interactions, creating innovative membrane structures to acquire favorable ion mixing effect and high separation performance remains a big challenge. Herein, we design covalent organic framework(COF) scaffold membrane with gate-lane nanostructure for efficient Li^(+)/Mg^(2+) separation. COF nanosheets, serving as the scaffold, are intercalated by polyethyleneimine(PEI) to form the permeating layer. Subsequently, PEI on the surface reacts with 1,4-phenylene diisocyanate to form the polyurea gating layer. The gating layer, bearing tailored smaller pore size,affords high rejection to co-ions(Mg^(2+)) and thus high Li^(+)/Mg^(2+) selectivity. The permeating layer, with asymmetric charge and spatial nanostructure for creating individual lanes of Li^(+) and Cl~-, facilitates Li^(+) transport and thus high Li^(+) permeability. The optimum COF scaffold membrane exhibits the permeance of 11.5 L m^(-2) h^(-1)/bar^(-1) and true selectivity of 231.9 with Li^(+) enrichment of 120.2% at the Mg^(2+)/Li^(+) mass ratio of 50, exceeding the ideal selectivity of 80.5 and outperforming all ever-reported positively charged nanofiltration membranes. Our work may stimulate the further thinking about how to design the hierarchical membrane structure to achieve favorable ion mixing effect and break the membrane permeability-selectivity trade-off in chemical separations. 展开更多
关键词 Covalent organic framework POLYETHYLENEIMINE Scaffold membrane Lithium/magnesium nanofiltration separation Ion mixing effect
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The Impact of Mother-Infant Separation on the Physical and Mental Health of Women with High-Risk Pregnancies and Corresponding Nursing Strategies
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作者 Qing Yang 《Journal of Clinical and Nursing Research》 2026年第1期145-152,共8页
Objective:To analyze the impact of maternal-infant separation on the physical and mental state of high-risk pregnancy patients and explore the clinical efficacy of targeted nursing interventions.Methods:A total of 80 ... Objective:To analyze the impact of maternal-infant separation on the physical and mental state of high-risk pregnancy patients and explore the clinical efficacy of targeted nursing interventions.Methods:A total of 80 high-risk pregnancy patients treated in our hospital from January 2023 to January 2024 were selected as the study subjects.These patients were randomly divided into an observation group and a control group(40 cases each)using a random number table.The control group received routine high-risk pregnancy nursing care,while the observation group received specialized maternal-infant separation nursing interventions in addition to routine care.The psychological and physiological states and nursing satisfaction of the two groups were compared before and after the intervention.Results:The SAS scores,SDS scores,and sleep quality scores of the observation group were significantly lower than those of the control group,with statistically significant differences(p<0.05).The incidence of postpartum hemorrhage in the observation group was significantly lower than that in the control group,and the initiation time of lactation was significantly earlier than that in the control group,with both differences being statistically significant(p<0.05).The nursing satisfaction of the observation group was significantly higher than that of the control group(80%vs.32/40),with a statistically significant difference(p<0.05).Conclusion:Maternal-infant separation exacerbates anxiety and depression in high-risk pregnancy patients,reduces sleep quality,increases the risk of postpartum hemorrhage,and delays the initiation of lactation.Specialized nursing interventions for maternal-infant separation can improve the physical and mental state of high-risk pregnancy patients,reduce the incidence of postpartum complications,and enhance nursing satisfaction,making them worthy of clinical application and promotion. 展开更多
关键词 Mother-infant separation High-risk pregnancy women Physical and mental health Nursing strategies
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Block-Wise Sliding Recursive Wavelet Transform and Its Application in Real-Time Vehicle-Induced Signal Separation
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作者 Jie Li Nan An Youliang Ding 《Structural Durability & Health Monitoring》 2026年第1期1-22,共22页
Vehicle-induced response separation is a crucial issue in structural health monitoring(SHM).This paper proposes a block-wise sliding recursive wavelet transform algorithm to meet the real-time processing requirements ... Vehicle-induced response separation is a crucial issue in structural health monitoring(SHM).This paper proposes a block-wise sliding recursive wavelet transform algorithm to meet the real-time processing requirements of monitoring data.To extend the separation target from a fixed dataset to a continuously updating data stream,a block-wise sliding framework is first developed.This framework is further optimized considering the characteristics of real-time data streams,and its advantage in computational efficiency is theoretically demonstrated.During the decomposition and reconstruction processes,information from neighboring data blocks is fully utilized to reduce algorithmic complexity.In addition,a delay-setting strategy is introduced for each processing window to mitigate boundary effects,thereby balancing accuracy and efficiency.Simulated signal experiments are conducted to determine the optimal delay configuration and to verify the algorithm’s superior performance,achieving a lower Root Mean Square Error(RMSE)and only 0.0249 times the average computational time compared with the original algorithm.Furthermore,strain signals from the Lieshi River Bridge are employed to validate the method.The proposed algorithm successfully separates the static trend from vehicle-induced responses in real time across different sampling frequencies,demonstrating its effectiveness and applicability in real-time bridge monitoring. 展开更多
关键词 Wavelet transform vehicle-induced signal separation real-time structure monitoring
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Experimental research and mechanism analysis of combined gravitymagnetic separation on coal gasification fine slag
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作者 Panpan Fan Zengqiang Ge +4 位作者 Zhenyang Ren Weiren Bao Jiancheng Wang Lianping Dong Minqiang Fan 《International Journal of Coal Science & Technology》 2025年第5期303-314,共12页
Coal gasification fine slag(CGFS)is a solid waste produced in the process of coal gasification.The separation of residue carbon in CGFS is essential for its resource utilization.In this study,the basic physical proper... Coal gasification fine slag(CGFS)is a solid waste produced in the process of coal gasification.The separation of residue carbon in CGFS is essential for its resource utilization.In this study,the basic physical properties of CGFS were analyzed and the effect of physical separation experiments were carried out.The gravity separation results indicated that the coarser particle size fraction achieved a good separation effect.The High-carbon product has a yield of 12.53% with an ash content of 16.84%,and the High-ash product has a yield of 17.85%with an ash content of 98.15% were obtained.Theoretical calculations indicated that the apparent density difference between residue carbon and ash minerals in the water phase environment was the basis for achieving separation.The Rich-ash product was further separated by magnetic separation,and both magnetic field characteristics,water elutriation frequency and grinding time had impacts on the magnetic separation effect.Compared to gravity separation alone,the combined gravity-magnetic separation further enhanced the separation effect of residue carbon and ash minerals.The ash content of the Rich-ash product decreased from 80.56% to 69.52% due to the removal of high-ash Fe oxides,and the yield of combined separation tailings increased from 17.85% to 41.75%.The characterization results obtained through SEM-EDS,VSM,XRD and XRF analysis demonstrated significant differences in saturation magnetization,mineral composition and peak intensity among magnetic separation products,confirming that the feasibility of magnetic separation.The research findings contribute to a better understanding of the separation mechanism and provide a new separation process for efficiently enriching residue carbon from CGFS,also facilitate the step utilization of separation products. 展开更多
关键词 Coal gasification slag Gravity separation Magnetic separation Combined separation process Solid waste
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Recent advances in chiral drug separation membranes:design,mechanisms,challenges,and prospects
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作者 Jianyu WANG Qindan CHU +2 位作者 Chuanjie FANG Baoku ZHU Liping ZHU 《Journal of Zhejiang University-Science A(Applied Physics & Engineering)》 2025年第4期285-304,共20页
The presence of chirality,a fundamental attribute found in nature,is of great significance in the field of pharmaceutical science.Chiral drugs are unique in that their molecular structure is non-superimposable on its ... The presence of chirality,a fundamental attribute found in nature,is of great significance in the field of pharmaceutical science.Chiral drugs are unique in that their molecular structure is non-superimposable on its mirror image.This stereoisomerism significantly impacts the functionality,metabolic pathway,effectiveness,and safety of chiral medications.The enantiomers of chiral drugs can exhibit diverse pharmacological effects in the human body.As a result,it is essential to separate and purify chiral drugs effectively.Despite the abundance of reports on chiral drug separation membranes,there is a dearth of comprehensive reviews.This paper aims to fill this gap by providing a thorough review from a materials perspective,with a focus on the design and construction of chiral drug separation membranes.Furthermore,it systematically analyzes the separation mechanisms employed by these membranes.The paper also delves into the challenges and prospects related to chiral drug separation membranes,with the intention of imparting valuable insights for further research and development in this field. 展开更多
关键词 Chiral drugs Chiral separation separation mechanisms Membrane separation
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A propane‑selective metal‑organic framework for inverse selective adsorption propane/propylene separation
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作者 YANG Shanqing WANG Lulu +3 位作者 ZHANG Qiang LI Jiajia LI Yilong HU Tongliang 《无机化学学报》 北大核心 2025年第10期2138-2148,共11页
We report a robust pillar-layered metal-organic framework,Zn‑tfbdc‑dabco(tfbdc:tetrafluoroterephthal-ate,dabco:1,4-diazabicyclo[2.2.2]octane),featuring the fluorinated pore environment,for the preferential binding of ... We report a robust pillar-layered metal-organic framework,Zn‑tfbdc‑dabco(tfbdc:tetrafluoroterephthal-ate,dabco:1,4-diazabicyclo[2.2.2]octane),featuring the fluorinated pore environment,for the preferential binding of propane over propylene and thus highly inverse selective separation of propane/propylene mixture.The inverse propane-selective performance of Zn‑tfbdc‑dabco for the propane/propylene separation was validated by single-component gas adsorption isotherms,isosteric enthalpy of adsorption calculations,ideal adsorbed solution theory calculations,along with the breakthrough experiment.The customized fluorinated networks served as a propane-trap to form more interactions with the exposed hydrogen atoms of propane,as unveiled by the simulation studies at the molecular level.With the advantage of inverse propane-selective adsorption behavior,high adsorption capacity,good cycling stability,and low isosteric enthalpy of adsorption,Zn‑tfbdc‑dabco can be a promising candidate adsorbent for the challenging propane/propylene separation to realize one-step purification of the target propylene substance. 展开更多
关键词 metal-organic framework propane/propylene separation inverse selective adsorption separation
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Application of Metal-Organic Frameworks (MOFs) in Gas Adsorption and Separation
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作者 Zhiqing Dong 《化学发展前沿(中英文版)》 2025年第1期1-7,共7页
Metal-Organic Frameworks(MOFs)have emerged as promising materials for gas adsorption and separation due to their exceptional surface area,tunable porosity,and versatility in functionalization.This paper explores the m... Metal-Organic Frameworks(MOFs)have emerged as promising materials for gas adsorption and separation due to their exceptional surface area,tunable porosity,and versatility in functionalization.This paper explores the mechanisms of gas adsorption in MOFs,including physical adsorption,chemisorption,and synergistic effects,which contribute to their efficiency in capturing and separating gases.The applications of MOFs in key areas such as carbon dioxide capture,hydrogen storage,natural gas separation,and air purification are discussed,highlighting their potential to address pressing environmental and energy challenges.Additionally,the use of MOFs in selective gas separation,membranes,and adsorption-based technologies like Pressure Swing Adsorption(PSA)and Vacuum Swing Adsorption(VSA)is explored,emphasizing their advantages over traditional materials.Despite challenges related to scalability,stability,and cost,MOFs hold great promise for advancing gas separation technologies in the near future,offering more efficient,sustainable,and environmentally friendly solutions. 展开更多
关键词 Metal-Organic Frameworks Gas Adsorption Gas separation Carbon Dioxide Capture Hydrogen Storage Natural Gas separation Pressure Swing Adsorption
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Experimental research on enhanced the microfine oil droplets separation using hydrocyclone coupled with fiber coalescence
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作者 Lian Zhang Zhaojin Lu +1 位作者 Likun Ma Zhishan Bai 《Chinese Journal of Chemical Engineering》 2025年第6期15-24,共10页
The limitations of swirl separation in removing microfine oil droplets in water have driven the development of hydrocyclone technology coupled with multiphase or multifield techniques.To enhance microfine oil droplets... The limitations of swirl separation in removing microfine oil droplets in water have driven the development of hydrocyclone technology coupled with multiphase or multifield techniques.To enhance microfine oil droplets separation,a novel hydrocyclone separation coupled with fiber coalescence(HCCFC) was designed.The interaction between fiber balls and oil droplets inside the hydrocyclone,including droplet coalescence and breakage,was investigated.The influence of different operating parameters on separation efficiency was discussed.The results showed that fiber balls promoted oil droplet coalescence when the inlet droplet size(D_(43)) was below 22.37 μm but caused droplet breakage above this threshold.The coalescence performance of HCCFC improved with increasing inlet oil content but declined beyond 450 mg·L^(-1).Separation experiments confirmed that HCCFC outperformed conventional hydrocyclone,with separation efficiency increasing by 2.9% to 20.0%.As the fiber ball content and inlet flow rate increased,the separation efficiency showed a trend of first increasing and then decreasing.Additionally,HCCFC's separation efficiency varied with inlet oil droplet size distribution,showing the most significant enhancement when D_(43) was 22.37 μm,where separation efficiency increased by 14.4%.These findings offer insights into the development and application of multiphase coupled with hydrocyclone technology. 展开更多
关键词 Oil–water separation Fiber coalescence HYDROCYCLONE BREAKAGE separation efficiency
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Computational screening of covalent organic frameworks for He purification with adsorption or membrane separation
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作者 Zenan Shi Lijun Liao +2 位作者 Shujun Peng Yanying Wei Libo Li 《Green Energy & Environment》 2025年第11期2143-2155,共13页
Separating He from CH_(4)or N_(2)is crucial for natural gas He extraction,a prevailing industrial approach.Herein,molecular simulation and machine learning(ML)were combined to screen 801 experimentally synthesized COF... Separating He from CH_(4)or N_(2)is crucial for natural gas He extraction,a prevailing industrial approach.Herein,molecular simulation and machine learning(ML)were combined to screen 801 experimentally synthesized COFs for He/CH_(4)and He/N_(2)separation,either by means of adsorption or membrane separation.Top 10 COFs for 4 different gas separation purposes(CH_(4)/He or N_(2)/He separation with either adsorption or membrane)were identified respectively.The highest adsorption performance score(APSmix,defined as the product of working capacity and adsorption selectivity for mixture gas)reached 447.88 mol/kg and 49.45 mol/kg for CH_(4)/He and N_(2)/He,with corresponding adsorption selectivity of 115.56 and 30.33.He permeabilities of 1.5×10^(6)or 1.2×10^(6)Barrer were achieved for equimolar He/CH_(4)or He/N_(2)mixture gas separations,accompanied by permselectivity of 5.47 and 11.80 well surpassing 2008 Robeson's upper bound.Best performing COFs for adsorption separation are 3D COFs with pore diameter below 0.8 nm while those for membrane separation are 2D COFs with large pores.Additionally,ML models were developed to predict separation performance,with key descriptors identified.The mechanism for how COFs'structure affects their separation performance was also revealed. 展开更多
关键词 Computational screening COFs Gas separation Adsorption and membrane separation Machine learning
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A comprehensive review on Mg-based materials as filler in mixed matrix membranes for CO_(2)separation
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作者 Payam Veisi Alireza Askari Arash Fattah-alhosseini 《Journal of Magnesium and Alloys》 2025年第2期539-561,共23页
The crisis of excessive increase in CO_(2)emissions has quickly become a serious issue and requires low-cost and bio-compatible solutions.The employee of membrane technology for CO_(2)gas separation has garnered signi... The crisis of excessive increase in CO_(2)emissions has quickly become a serious issue and requires low-cost and bio-compatible solutions.The employee of membrane technology for CO_(2)gas separation has garnered significant interest among researchers.However,this method encounters challenges related to selectivity and permeability.Therefore,modifying and reinforcing the polymer membranes to improve gas separation performance seems essential.Among the various methods for polymer membrane modification,modification with magnesium-based fillers to prepare a mixed matrix membrane(MMM)is considered an efficient method.Owing to magnesium metal's low weight,low density,high strength,and good selectivity,magnesium-based materials(Mg-based materials)have more porosity,higher available surface area,more adsorption sites,lighter weight,and more gas absorption tendency than other fillers,which makes them an attractive choice for the preparation of gas separation MMMs.This research deals with the introduction of Mg-based materials,various methods of synthesis of Mg-based materials,different methods of introducing Mg-based materials into the membrane matrix,and their effect on the performance of MMMs in CO_(2)gas separation applications.Therefore,this review can provide researchers with light horizons in using the high potential of Mg-based materials as efficient fillers in MMMs to achieve excellent permeability and selectivity and generally improve their performance in CO_(2)gas separation applications. 展开更多
关键词 Mg-based materials Mg-based fillers Mixed matrix membrane(mmm) Co2 separation Gas separation applications
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Perfect separation of pyridine and 3-methylpyridine by cucurbit[6]uril
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作者 Yongqing Zeng Caijun Liang +7 位作者 Xin Lu Lingxue Zhao Fangting Wu Tao Hou Anting Zhao Menglan Lv Zhu Tao Qing Li 《Chinese Chemical Letters》 2025年第9期330-333,共4页
Pyridine(Py) and 3-methylpyridine(3-MP) are crucial intermediates in chemical industrial processes.Here,we provide a simple and energy-efficient approach for the isolation of Py and 3-MP by employing crystalline cucur... Pyridine(Py) and 3-methylpyridine(3-MP) are crucial intermediates in chemical industrial processes.Here,we provide a simple and energy-efficient approach for the isolation of Py and 3-MP by employing crystalline cucurbit[6]uril(Q[6]).The crystal exhibit high selectivity for Py from the mixture of Py and 3-MP in both vapor and liquid phases,with separation purities close to 100%.The selectivity is attributed to the varying stability of the host-vip complexes after the absorption of Py or 3-MP,as revealed by the single-crystal structure analysis.ITC experimental results and DFT calculations indicate that,compared to3-MP,Q[6] has a higher binding strength and lower binding energy with Py.In addition,pyridine can be removed from the Q[6] cavity through vacuum heating or organic solvent immersion,enabling Q[6]reuse via reversible vip loading.This method offers a promising approach for high-purity Py and 3-MP separation with significant economic and environmental benefits. 展开更多
关键词 uril Molecules separation Adsorptive separation Host–vip complexation Supramolecular chemistry
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Development and application of chiral separation technology based on chiral metal-organic frameworks
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作者 Gege Zhu Li Ge +4 位作者 Xinyu Li Bing Niu Qin Chen Dan Zhong Xiaodong Sun 《Journal of Pharmaceutical Analysis》 2025年第7期1409-1426,共18页
Chirality is not only a natural phenomenon but also a bridge between chemistry and life sciences.An effective way to obtain a single enantiomer is through racemates resolution.Recent literature shows that chiral metal... Chirality is not only a natural phenomenon but also a bridge between chemistry and life sciences.An effective way to obtain a single enantiomer is through racemates resolution.Recent literature shows that chiral metal-organic frameworks(CMOFs)have many applications in various fields because of their diverse topologies and functionalities.This review outlines the design idea and summarizes the latest synthesis strategies and applications of CMOFs.It highlights key advances and issues in the separation domain.In conclusion,the review provides perspectives on the challenges and prospective advancements of CMOFs materials and CMOFs-based separation technologies. 展开更多
关键词 Chiral metal-organic frameworks Enantiomer separation Chromatographic technology Membrane separation
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Separation and utilization of iron,cerium,and other rare earth elements from rare earth waste by chlorination
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作者 Wangjun Lin Xiaoshan Zhu +4 位作者 Youwei Liu Xiang Lei Shuyuan Lin Yuxin Gao Jinliang Wang 《Journal of Rare Earths》 2025年第11期2531-2537,I0007,共8页
Due to the lack of effective screening systems in the rare earth waste recycling industry,the composition of rare earth elements in rare earth waste is complex and difficult to separate.In response to such problems,by... Due to the lack of effective screening systems in the rare earth waste recycling industry,the composition of rare earth elements in rare earth waste is complex and difficult to separate.In response to such problems,by studying the reaction behavior between various elements in rare earth waste and cobalt chloride,we propose a process path for the separation and recovery of iron,cerium and other rare earth elements using cobalt chloride roasting.The experiments on simulated wastes show that the leaching rates of the Nd,Sm,Gd,Pr can reach 98.31%,94.5%,93.87%and 72.05%under the optimal process conditions,respectively.Ce and iron remain in the leaching residue in the form of CeO_(2)and CoFe_(2)O_(4),respectively.And through a simple magnetic separation process,CeO_(2)and CoFe_(2)O_(4)can be enriched in non-magnetic leaching residue and magnetic leaching residue,respectively.The cerium content in the leaching residue composed of cobalt ferrite is only 1.95%.Therefore,this method is beneficial to the separation and high-value utilization of iron,cerium,and other rare earth elements in the waste system.The research results can provide theoretical reference for the low-cost and high-value recovery of rare earth secondary resources. 展开更多
关键词 Rare earths Chlorination roasting Selective separation Magnetic separation Cobalt ferrite
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Factors affecting the performance of membranes for H_(2)/CH_(4)separation from the perspective of separation mechanisms
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作者 Shiyin Sun Shuangde Li Yunfa Chen 《Green Energy & Environment》 2025年第10期2047-2070,共24页
The production of high-purity H_(2) is the building block of hydrogen economy,which can greatly promote the construction of related technologies and infrastructure.Efficient H_(2)/CH_(4) separation is a necessary unit... The production of high-purity H_(2) is the building block of hydrogen economy,which can greatly promote the construction of related technologies and infrastructure.Efficient H_(2)/CH_(4) separation is a necessary unit in producing high-purity energy and reducing greenhouse gas emissions,which can meet the industrial demand and help to address the energy issue and achieve global carbon neutrality goals.Membrane separation technology,as a promising strategy for H_(2) purification,has attracted much attention due to its high efficiency,energy conservation and versatile applications.This article reviews the latest research advances in the high-performance membranes for H_(2)/CH_(4) separation,and elu-cidates the effect of membrane materials,preparation methods and membrane structure on separation performance from the perspective of separation mechanisms.It also summarized the essential aspects of membrane design,such as microstructural regulation,multiphase coupling,the optimal usage conditions and simple analysis of economic benefits.Finally,the current challenges and future directions of membranes for H_(2)/CH_(4) separation were discussed,intending to provide in-depth reference and inspiration for the theoretical research and practical application of membrane separation technology. 展开更多
关键词 H_(2)/CH_(4)separation separation mechanism Membrane design Economic evaluation
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Efficient C_(3)H_(6)/C_(3)H_(8) separation within a bifunctional ultramicroporous metal-organic framework with high purity and record packing density
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作者 Shan-Qing Yang Lu-Lu Wang +7 位作者 Rajamani Krishna Bo Xing Lei Zhou Fei-Yang Zhang Qiang Zhang Yi-Long Li Chao-Sheng Bao Tong-Liang Hu 《Chinese Chemical Letters》 2025年第12期500-504,共5页
The propylene/propane(C_(3)H_(6)/C_(3)H_(8))separation is particularly challenging due to their highly similar physical properties,but of industrial importance.Herein,we report a bifunctional ultramicroporous metal-or... The propylene/propane(C_(3)H_(6)/C_(3)H_(8))separation is particularly challenging due to their highly similar physical properties,but of industrial importance.Herein,we report a bifunctional ultramicroporous metal-organic framework(Co-aip-pyz)with customized pore environment and selective binding sites for the challenging C_(3)H_(6)/C_(3)H_(8) separation.Co-aip-pyz exhibits a good C_(3)H_(6) uptake with an ultrahigh C_(3)H_(6) packing density(931 g/L),as well as possesses a remarkable C_(3)H_(6)/C_(3)H_(8) uptake ratio with 911% and distinguished C_(3)H_(6)/C_(3)H_(8) selectivity(>10^(4))at 298 K and 1.0 bar.Furthermore,Co-aip-pyz possesses a record high C_(3)H_(6) packing density with 859 g/L at 313 K and 1.0 bar,which is unprecedented in the C_(3)H_(6)/C_(3)H_(8) separation.Its high performance for the C_(3)H_(6)/C_(3)H_(8) separation has been further confirmed by breakthrough experiments and molecular simulations.Combined with good stability,facilely synthesized procedure by low-cost precursors,record-high C_(3)H_(6) packing density,as well as good C_(3)H_(6)/C_(3)H_(8) separation performance,it highlights Co-aip-pyz as a benchmark adsorbent to address daunting challenge for industrial C_(3)H_(6)/C_(3)H_(8) separation.This work provides valuable insights into constructing top-performing MOF materials for addressing the industrial separation challenges. 展开更多
关键词 Metal-organic frameworks Gas adsorption and separation C_(3)H_(6)purification C_(3)H_(6)/C_(3)H_(8)separation C_(3)H_(6)packing density
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