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Optimization of Preparation of Fe_(3)O_(4)-L by Chemical Co-Precipitation and Its Adsorption of Heavy Metal Ions
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作者 Junzhen Di Xueying Sun +2 位作者 Siyi Zhang Yanrong Dong Bofu Yuan 《Journal of Renewable Materials》 SCIE EI 2023年第5期2209-2232,共24页
To address the serious pollution of heavy metals in AMD,the difficulty and the high cost of treatment,Fe_(3)O_(4)-L was prepared by the chemical co-precipitation method.Based on the single-factor and RSM,the effects o... To address the serious pollution of heavy metals in AMD,the difficulty and the high cost of treatment,Fe_(3)O_(4)-L was prepared by the chemical co-precipitation method.Based on the single-factor and RSM,the effects of particle size,total Fe concentration,the molar ratio of Fe^(2+)to Fe^(3+)and water bath temperature on the removal of AMD by Fe_(3)O_(4)-L prepared by chemical co-precipitation method were analyzed.Static adsorption experiments were conducted on Cu^(2+),Zn^(2+)and Pb^(2+)using Fe_(3)O_(4)-L prepared under optimal conditions as adsorbents.The adsorption properties and mechanisms were analyzed by combining SEM-EDS,XRD and FTIR for characterization.The study showed that the effects of particle size,total Fe concentration and the molar ratio of Fe^(2+)to Fe^(3+)are larger.Obtained by response surface optimization analysis,the optimum conditions for the preparation of Fe_(3)O_(4)-L were a particle size of 250 mesh,a total Fe concentration of 0.5 mol/L,and a molar ratio of Fe^(2+)to Fe^(3+)of 1:2.Under these conditions,the removal rates of Cu^(2+),Zn^(2+),and Pb^(2+)were 94.52%,88.49%,and 96.69%respectively.The adsorption of Cu^(2+),Zn^(2+)and Pb^(2+)by Fe_(3)O_(4)-L prepared under optimal conditions reached equilibrium at 180 min,with removal rates of 99.99%,85.27%,and 97.48%,respectively.The adsorption reaction of Fe_(3)O_(4)-L for Cu^(2+)and Zn^(2+)is endothermic,while that for Pb^(2+)is exothermic.Fe_(3)O_(4)-L can still maintain a high adsorption capacity after five cycles of adsorption-desorption experiments.Cu^(2+),Zn^(2+)and Pb^(2+)mainly exist as CuFe_(2)O_(4),Zn(OH)2,ZnFe_(2)O_(4)and PbS after being adsorbed by Fe_(3)O_(4)-L,which is the result of the combination of physical diffusion,ion exchange and surface complexation reaction. 展开更多
关键词 chemical co-precipitation Fe_(3)O_(4)-L single-factor experiment RSM ADSORPTION characterization
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Effects of Heating Processing on Microstructure and Magnetic Properties of Mn-Zn Ferrites Prepared via Chemical Co-precipitation 被引量:2
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作者 陈世杰 XIA Jingbing 代建清 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2015年第4期684-688,共5页
The fine powders of Mn-Zn ferrites with uniform size were prepared via chemical co- precipitation method. X-ray diffraction analysis (XRD), scanning electron microscopy (SEM), vibrating sample magnetometer (VSM)... The fine powders of Mn-Zn ferrites with uniform size were prepared via chemical co- precipitation method. X-ray diffraction analysis (XRD), scanning electron microscopy (SEM), vibrating sample magnetometer (VSM), frequency dependence of permeability and metallographical microscope were used to investigate the crystal structure, surface topography and magnetic properties of the powders and the sintering samples. The experimental results demonstrate that the precursor powders have formed a pure phase cubic spinel MnxZn1-xfe2O4 while in the reactor and show definite magnetism, which can solve the difficult issue in washing process effectively. When calcined beneath 450 ℃, the powders have intact crystal form and the crystallite size is less than 20 nm. Comparison tests of sintering temperatures show that 1 300 ℃ is the ideal sintering temperature for Mn-Zn ferrites prepared by using the chemical co-precipitation. 展开更多
关键词 Mn-Zn ferrites chemical co-precipitation method surface morphology MAGNETICPROPERTIES
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High-rate removal of As(Ⅲ) from aqueous system with sulfhydryl magnetic biological bamboo charcoal nanocomposites prepared by chemical co-precipitation method
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作者 Yi-wei LUO Si WAN +1 位作者 Jiang-jun XIAO Dai-she WU 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2022年第8期2757-2769,共13页
Sulfhydryl magnetic biological bamboo charcoal nanocomposite(BBC@nFe-SH)was prepared by chemical co-precipitation method for the robust capture of As(Ⅲ)from aqueous solutions.The novel BBC@nFe-SH shows favorable magn... Sulfhydryl magnetic biological bamboo charcoal nanocomposite(BBC@nFe-SH)was prepared by chemical co-precipitation method for the robust capture of As(Ⅲ)from aqueous solutions.The novel BBC@nFe-SH shows favorable magnetic field strength(83376 A/m),which enables BBC@nFe-SH to be quickly recovered from aqueous solution.The maximum As(Ⅲ)adsorption capacity is as high as 98.63 mg/g at pH 5.0 and 40°C,reaching reaction equilibrium within 120 min.Various characterizations(e.g.,SEM,FTIR,VSM and XPS)suggest that As(Ⅲ)prefers to coordinate with surface oxygen groups bonded to the surface.BBC@nFe-SH displayed high stability and recyclability throughout the removal process,which could be easily activated by 1 mol/L NaOH after usage.Thus,the novel BBC@nFe-SH has promising applications for As(Ⅲ)treatment. 展开更多
关键词 arsenic-containing wastewater bamboo biochar chemical co-precipitation adsorption RECYCLABILITY wastewater treatment
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Ultra-fine W-Y_(2)O_(3)composite powders prepared by an improved chemical co-precipitation method and its interface structure after spark plasma sintering 被引量:5
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作者 Weiqiang Hu Qingshuang Ma +3 位作者 Zongqing Ma Yuan Huang Zumin Wang Yongchang Liu 《Tungsten》 2019年第3期220-228,共9页
Y_(2)O_(3)-doped tungsten(W-Y_(2)O_(3))composite powders prepared by a traditional chemical co-precipitation method possess obvious bimodal distribution in size,which would deteriorate their sintering properties.The b... Y_(2)O_(3)-doped tungsten(W-Y_(2)O_(3))composite powders prepared by a traditional chemical co-precipitation method possess obvious bimodal distribution in size,which would deteriorate their sintering properties.The bimodal distribution can be effectively eliminated by an improved chemical co-precipitation method,in which the cationic surfactant cetyltrimethyl-ammonium bromide(CTAB)was innovatively employed.The reduced powders with excellent uniformity have an average grain size of only~31.5 nm.It is noteworthy that Y_(2)O_(3)particles would fuse and grow with the growth of W grains during subsequent spark plasma sintering(SPS)process,which was rarely reported in relevant literature before.On top of that,phase interfaces of sintered W-Y_(2)O_(3)alloys were systematically analyzed.Compared to the intracrystalline oxygen content,the oxygen content at W/Y_(2)O_(3)phase boundaries is relatively higher.It can be found that the(110)crystal planes of W form coherent,semi-coherent,and non-coherent interfaces with different crystal planes of Y_(2)O_(3).The weak interfacial bonding strength between W and Y_(2)O_(3)phases results from relatively more oxygen impurities as well as more semi-coherent/non-coherent interfaces at phase boundaries compared with the inner W grains. 展开更多
关键词 Y_(2)O_(3)-doped tungsten chemical co-precipitation method CTAB SPS Phase boundary
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Jet formation and penetration performance of a double-layer charge liner with chemically-deposited tungsten as the inner liner 被引量:1
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作者 Bihui Hong Wenbin Li +2 位作者 Yiming Li Zhiwei Guo Binyou Yan 《Defence Technology(防务技术)》 SCIE EI CAS CSCD 2024年第3期374-385,共12页
This paper proposes a type of double-layer charge liner fabricated using chemical vapor deposition(CVD)that has tungsten as its inner liner.The feasibility of this design was evaluated through penetration tests.Double... This paper proposes a type of double-layer charge liner fabricated using chemical vapor deposition(CVD)that has tungsten as its inner liner.The feasibility of this design was evaluated through penetration tests.Double-layer charge liners were fabricated by using CVD to deposit tungsten layers on the inner surfaces of pure T2 copper liners.The microstructures of the tungsten layers were analyzed using a scanning electron microscope(SEM).The feasibility analysis was carried out by pulsed X-rays,slug-retrieval test and static penetration tests.The shaped charge jet forming and penetration law of inner tungsten-coated double-layer liner were studied by numerical simulation method.The results showed that the double-layer liners could form well-shaped jets.The errors between the X-ray test results and the numerical results were within 11.07%.A slug-retrieval test was found that the retrieved slug was similar to a numerically simulated slug.Compared with the traditional pure copper shaped charge jet,the penetration depth of the double-layer shaped charge liner increased by 11.4% and>10.8% respectively.In summary,the test results are good,and the numerical simulation is in good agreement with the test,which verified the feasibility of using the CVD method to fabricate double-layer charge liners with a high-density and high-strength refractory metal as the inner liner. 展开更多
关键词 Shaped charge chemical vapor deposition TUNGSTEN Double-layer charge liner X-ray PENETRATION
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Valorization of Camellia oleifera oil processing byproducts to value-added chemicals and biobased materials: A critical review 被引量:1
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作者 Xudong Liu Yiying Wu +11 位作者 Yang Gao Zhicheng Jiang Zicheng Zhao Wenquan Zeng Mingyu Xie Sisi Liu Rukuan Liu Yan Chao Suli Nie Aihua Zhang Changzhu Li Zhihong Xiao 《Green Energy & Environment》 SCIE EI CAS CSCD 2024年第1期28-53,共26页
The C.oleifera oil processing industry generates large amounts of solid wastes,including C.oleifera shell(COS)and C.oleifera cake(COC).Distinct from generally acknowledged lignocellulosic biomass(corn stover,bamboo,bi... The C.oleifera oil processing industry generates large amounts of solid wastes,including C.oleifera shell(COS)and C.oleifera cake(COC).Distinct from generally acknowledged lignocellulosic biomass(corn stover,bamboo,birch,etc.),Camellia wastes contain diverse bioactive substances in addition to the abundant lignocellulosic components,and thus,the biorefinery utilization of C.oleifera processing byproducts involves complicated processing technologies.This reviewfirst summarizes various technologies for extracting and converting the main components in C.oleifera oil processing byproducts into value-added chemicals and biobased materials,as well as their potential applications.Microwave,ultrasound,and Soxhlet extractions are compared for the extraction of functional bioactive components(tannin,flavonoid,saponin,etc.),while solvothermal conversion and pyrolysis are discussed for the conversion of lignocellulosic components into value-added chemicals.The application areas of these chemicals according to their properties are introduced in detail,including utilizing antioxidant and anti-in-flammatory properties of the bioactive substances for the specific application,as well as drop-in chemicals for the substitution of unrenewable fossil fuel-derived products.In addition to chemical production,biochar fabricated from COS and its applications in thefields of adsorption,supercapacitor,soil remediation and wood composites are comprehensively reviewed and discussed.Finally,based on the compositions and structural characteristics of C.oleifera byproducts,the development of full-component valorization strategies and the expansion of the appli-cationfields are proposed. 展开更多
关键词 Camellia oleifera shell Camellia oleifera cake Value-added chemicals Bioactive components Biobased materials
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A novel method for simulating nuclear explosion with chemical explosion to form an approximate plane wave: Field test and numerical simulation 被引量:1
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作者 Wei Ming Xiaojie Yang +3 位作者 Yadong Mao Xiang Wang Manchao He Zhigang Tao 《Journal of Rock Mechanics and Geotechnical Engineering》 SCIE CSCD 2024年第6期2137-2153,共17页
A nuclear explosion in the rock mass medium can produce strong shock waves,seismic shocks,and other destructive effects,which can cause extreme damage to the underground protection infrastructures.With the increase in... A nuclear explosion in the rock mass medium can produce strong shock waves,seismic shocks,and other destructive effects,which can cause extreme damage to the underground protection infrastructures.With the increase in nuclear explosion power,underground protection engineering enabled by explosion-proof impact theory and technology ushered in a new challenge.This paper proposes to simulate nuclear explosion tests with on-site chemical explosion tests in the form of multi-hole explosions.First,the mechanism of using multi-hole simultaneous blasting to simulate a nuclear explosion to generate approximate plane waves was analyzed.The plane pressure curve at the vault of the underground protective tunnel under the action of the multi-hole simultaneous blasting was then obtained using the impact test in the rock mass at the site.According to the peak pressure at the vault plane,it was divided into three regions:the stress superposition region,the superposition region after surface reflection,and the approximate plane stress wave zone.A numerical simulation approach was developed using PFC and FLAC to study the peak particle velocity in the surrounding rock of the underground protective cave under the action of multi-hole blasting.The time-history curves of pressure and peak pressure partition obtained by the on-site multi-hole simultaneous blasting test and numerical simulation were compared and analyzed,to verify the correctness and rationality of the formation of an approximate plane wave in the simulated nuclear explosion.This comparison and analysis also provided a theoretical foundation and some research ideas for the ensuing study on the impact of a nuclear explosion. 展开更多
关键词 Approximate plane wave Multi-hole simultaneous blasting chemical explosion Nuclear explosion Pressure sensor inclusion
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Experimental investigation into effects of the natural polymer and nanoclay particles on the EOR performance of chemical flooding in carbonate reservoirs
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作者 Amir Mohammad Zamani Ashkan Moslemi Kamran Hassani 《Petroleum Science》 SCIE EI CAS CSCD 2024年第2期951-961,共11页
This paper aims to investigate the tragacanth gum potential as a natural polymer combined with natural clay mineral(montmorillonite,kaolinite,and illite)nanoparticles(NPs)to form NP-polymer suspension for enhanced oil... This paper aims to investigate the tragacanth gum potential as a natural polymer combined with natural clay mineral(montmorillonite,kaolinite,and illite)nanoparticles(NPs)to form NP-polymer suspension for enhanced oil recovery(EOR)in carbonate reservoirs.Thermal gravimetric analysis(TGA)tests were conducted initially in order to evaluate the properties of tragacanth gum.Subsequently,scanning electron microscopy(SEM)and energy-dispersive X-ray(EDX)tests were used to detect the structure of clay particles.In various scenarios,the effects of natural NPs and polymer on the wettability alteration,interfacial tension(IFT)reduction,viscosity improvement,and oil recovery were investigated through contact angle system,ring method,Anton Paar viscometer,and core flooding tests,respectively.The entire experiment was conducted at 25,50,and 75℃,respectively.According to the experimental results,the clay minerals alone did not have a significant effect on viscosity,but the addition of minerals to the polymer solution leads to the viscosity enhancement remarkably,resulting mobility ratio improvement.Among clay NPs,the combination of natural polymer and kaolinite results in increased viscosity at all temperatures.Considerable wettability alteration was also observed in the case of natural polymer and illite NPs.Illite in combination with natural polymer showed an ability in reducing IFT.Finally,the results of displacement experiments revealed that the combination of natural polymer and kaolinite could be the best option for EOR due to its substantial ability to improve the recovery factor. 展开更多
关键词 chemical flooding Tragacanth gum Clay nanoparticle WETTABILITY IFT
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Rational design of F,N-rich artificial interphase via chemical prelithiation initiation strategy enabling high coulombic efficiency and stable micro-sized SiO anodes
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作者 Quanyan Man Hengtao Shen +3 位作者 Chuanliang Wei Baojuan Xi Shenglin Xiong Jinkui Feng 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第5期224-232,共9页
Silicon monoxide(SiO)is regarded as a potential candidate for anode materials of lithium-ion batteries(LIBs).Unfortunately,the application of SiO is limited by poor initial Coulombic efficiency(ICE)and unsteady solid ... Silicon monoxide(SiO)is regarded as a potential candidate for anode materials of lithium-ion batteries(LIBs).Unfortunately,the application of SiO is limited by poor initial Coulombic efficiency(ICE)and unsteady solid electrolyte interface(SEI),which induce low energy,short cycling life,and poor rate properties.To address these drawbacks of SiO,we achieve in-situ construction of robust and fast-ion conducting F,N-rich SEI layer on prelithiated micro-sized SiO(P-μSiO)via the simple and continuous treatment ofμSiO in mild lithium 4,4′-dimethylbiphenyl solution and nonflammable hexafluorocyclotriphosphazene solution.Chemical prelithiation eliminates irreversible capacity through pre-forming inactive lithium silicates.Meanwhile,the symbiotic F,N-rich SEI with good mechanical stability and fast Li^(+)permeability is conductive to relieve volume expansion ofμSiO and boost the Li+diffusion kinetics.Consequently,the P-μSiO realizes an impressive electrochemical performance with an elevated ICE of 99.57%and a capacity retention of 90.67%after 350 cycles.Additionally,the full cell with P-μSiO anode and commercial LiFePO_(4) cathode displays an ICE of 92.03%and a high reversible capacity of 144.97 mA h g^(-1).This work offers a general construction strategy of robust and ionically conductive SEI for advanced LIBs. 展开更多
关键词 chemical prelithiation Silicon monoxide SEI Lithium-ion batteries INTERPHASE engineering
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Extraction,chemical components,bioactive functions and adulteration identification of walnut oils:A review
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作者 Yuan Gao Jia Hu +6 位作者 Xia Su Qi Li Caihong Su Yongling Li Gaiqin Ma Siyu Zhang Xiuzhu Yu 《Grain & Oil Science and Technology》 CAS 2024年第1期30-41,共12页
Walnut oil is a functional wood oil known to researchers that may potentially be a large source of Chinese edible oils.There are various extraction methods for walnut oil,including traditional(pressing,solvent-and enz... Walnut oil is a functional wood oil known to researchers that may potentially be a large source of Chinese edible oils.There are various extraction methods for walnut oil,including traditional(pressing,solvent-and enzymeassisted extraction)and novel methods(microwave,ultrasound,supercritical CO_(2),subcritical and other extraction technologies).Walnut oil is rich in nutrients,including phytosterols,tocopherols,polyphenols,squalene and minerals.It provides many health benefits,such as antioxidant,antitumor,anti-inflammatory,antidiabetic and lipid metabolism-related functions.In addition,the authentication of walnut oil has received much research attention.The present review provides detailed research on walnut oil extraction,composition,health benefits and adulteration identification methods.The path toward further walnut oil improvement in the context of the market value of walnut oil is also discussed. 展开更多
关键词 Extraction technology chemical composition Bioactive AUTHENTICATION
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Causal temporal graph attention network for fault diagnosis of chemical processes
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作者 Jiaojiao Luo Zhehao Jin +3 位作者 Heping Jin Qian Li Xu Ji Yiyang Dai 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第6期20-32,共13页
Fault detection and diagnosis(FDD)plays a significant role in ensuring the safety and stability of chemical processes.With the development of artificial intelligence(AI)and big data technologies,data-driven approaches... Fault detection and diagnosis(FDD)plays a significant role in ensuring the safety and stability of chemical processes.With the development of artificial intelligence(AI)and big data technologies,data-driven approaches with excellent performance are widely used for FDD in chemical processes.However,improved predictive accuracy has often been achieved through increased model complexity,which turns models into black-box methods and causes uncertainty regarding their decisions.In this study,a causal temporal graph attention network(CTGAN)is proposed for fault diagnosis of chemical processes.A chemical causal graph is built by causal inference to represent the propagation path of faults.The attention mechanism and chemical causal graph were combined to help us notice the key variables relating to fault fluctuations.Experiments in the Tennessee Eastman(TE)process and the green ammonia(GA)process showed that CTGAN achieved high performance and good explainability. 展开更多
关键词 chemical processes Safety Fault diagnosis Causal discovery Attention mechanism Explainability
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The chemical environment and structural ordering in liquid Mg-Y-Zn system:An ab-initio molecular dynamics investigation of melt for the formation mechanism of LPSO structure
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作者 Tangpeng Ma Jin Wang +5 位作者 Kaiming Cheng Chengwei Zhan Jixue Zhou Jingyu Qin Guochen Zhao Xinfang Zhang 《Journal of Magnesium and Alloys》 SCIE EI CAS CSCD 2024年第2期815-824,共10页
In an effort to clarify the formation mechanism of LPSO structure in Mg-Y-Zn alloy,the chemical environment and structural ordering in liquid Mg-rich Mg-Y-Zn system are investigated with the aid of ab-initio molecular... In an effort to clarify the formation mechanism of LPSO structure in Mg-Y-Zn alloy,the chemical environment and structural ordering in liquid Mg-rich Mg-Y-Zn system are investigated with the aid of ab-initio molecular dynamics simulation.In liquid Mg-rich Mg-Y alloys,the strong Mg-Y interaction is determined,which promotes the formation of fivefold symmetric local structure.For Mg-Zn alloys,the weak Mg-Zn interaction results in the fivefold symmetry weakening in the liquid structure.Due to the coexistence of Y and Zn,the strong attractive interaction is introduced in liquid Mg-Y-Zn ternary alloy,and contributes to the clustering of Mg,Y,Zn launched from Zn.What is more,the distribution of local structures becomes closer to that in pure Mg compared with that in binary Mg-Y and Mg-Zn alloys.These results should relate to the origins of the Y/Zn segregation zone and close-packed stacking mode in LPSO structure,which provides a new insight into the formation mechanism of LPSO structure at atomic level. 展开更多
关键词 Mg-Y-Zn chemical environment Structural ordering ab-initio molecular dynamics
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Plant Chemical Defenses against Insect Herbivores—Using theWild Tobacco as a Model
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作者 Guangwei Sun Xuanhao Zhang +4 位作者 Yi Liu Liguang Chai Daisong Liu Zhenguo Chen Shiyou Lü 《Phyton-International Journal of Experimental Botany》 SCIE 2024年第4期641-659,共19页
The Nicotiana genus, commonly known as tobacco, holds significant importance as a crucial economic crop. Confrontedwith an abundance of herbivorous insects that pose a substantial threat to yield, tobacco has develope... The Nicotiana genus, commonly known as tobacco, holds significant importance as a crucial economic crop. Confrontedwith an abundance of herbivorous insects that pose a substantial threat to yield, tobacco has developed adiverse and sophisticated array of mechanisms, establishing itself as a model of plant ecological defense. Thisreview provides a concise overview of the current understanding of tobacco’s defense strategies against herbivores.Direct defenses, exemplified by its well-known tactic of secreting the alkaloid nicotine, serve as a potent toxinagainst a broad spectrum of herbivorous pests. Moreover, in response to herbivore attacks, tobacco enhancesthe discharge of volatile compounds, harnessing an indirect strategy that attracts the predators of the herbivores.The delicate balance between defense and growth leads to the initiation of most defense strategies only after aherbivore attack. Among plant hormones, notably jasmonic acid (JA), play central roles in coordinating thesedefense processes. JA signaling interacts with other plant hormone signaling pathways to facilitate the extensivetranscriptional and metabolic adjustments in plants following herbivore assault. By shedding light on these ecologicaldefense strategies, this review emphasizes not only tobacco’s remarkable adaptability in its natural habitatbut also offers insights beneficial for enhancing the resilience of current crops. 展开更多
关键词 TOBACCO HERBIVORE chemical defense jasmonic acid REGULATION
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Expanding the Boundaries of the Chemical Space of DNA Methyltransferase 1 Modulators
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作者 Massyel S. Martínez-Cortés Diana L. Prado-Romero José L. Medina-Franco 《Computational Molecular Bioscience》 2024年第1期1-16,共16页
DNA methyltransferase 1 (DNMT1), one of the main epigenetic targets, is involved in the duplication of the DNA methylation pattern during replication, and it is essential for proper mammalian development. Small molecu... DNA methyltransferase 1 (DNMT1), one of the main epigenetic targets, is involved in the duplication of the DNA methylation pattern during replication, and it is essential for proper mammalian development. Small molecule DNMT1 modulators are attractive for biochemical epigenetic studies and have the potential to become drugs. So far, more than five hundred small molecules have been reported as DNMT1 inhibitors. However, only a limited number of DNMT1 activators have been disclosed because, at least in part, DNMT1 activators are typically regarded as negative data in virtual screening campaigns or optimization projects. This manuscript aims to report the chemical structures and biological activity of small molecules that increase the enzymatic activity of DNMT1. Results of the biochemical experimental assays are discussed. It was found that small molecule activators have a large variety of chemical scaffolds but share pharmacophore features. Visual analysis of the chemical space and multiverse based on molecular fingertips supported that activators are structurally diverse. This is the first report of eight small molecules that increase the enzymatic activity of DNMT1 by more than 400% in an enzymatic-based assay. The outcome warrants further investigation of the epigenetic activity of the compounds in a counter-screen assay, e.g., cell-based and in vivo context. 展开更多
关键词 chemical Multiverse CHEMOINFORMATICS EPIGENETICS Pharmacophore Hypothesis Small Molecules
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Chemical looping reforming of the micromolecular component from biomass pyrolysis via Fe_(2)O_(3)@SBA-16
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作者 Yunchang Li Bo Zhang +3 位作者 Xiantan Yang Bolun Yang Shengyong Zhang Zhiqiang Wu 《International Journal of Coal Science & Technology》 EI CAS CSCD 2024年第3期120-134,共15页
To solve the problems of low gasification efficiency and high tar content caused by solid–solid contact between biomass and oxygen carrier in traditional biomass chemical looping gasification process.The decoupling s... To solve the problems of low gasification efficiency and high tar content caused by solid–solid contact between biomass and oxygen carrier in traditional biomass chemical looping gasification process.The decoupling strategy was adopted to decouple the biomass gasification process,and the composite oxygen carrier was prepared by embedding Fe_(2)O_(3) in molecular sieve SBA-16 for the chemical looping reforming process of pyrolysis micromolecular model compound methane,which was expected to realize the directional reforming of pyrolysis volatiles to prepare hydrogen-rich syngas.Thermodynamic analysis of the reaction system was carried out based on the Gibbs free energy minimization method,and the reforming performance was evaluated by a fixed bed reactor,and the kinetic parameters were solved based on the gas–solid reaction model.Thermodynamic analysis verified the feasibility of the reaction and provided theoretical guidance for experimental design.The experimental results showed that the reaction performance of Fe_(2)O_(3)@SBA-16 was compared with that of pure Fe_(2)O_(3) and Fe_(2)O_(3)@SBA-15,and the syngas yield was increased by 55.3%and 20.7%respectively,and it had good cycle stability.Kinetic analysis showed that the kinetic model changed from three-dimensional diffusion to first-order reaction with the increase of temperature.The activation energy was 192.79 kJ/mol by fitting.This paper provides basic data for the directional preparation of hydrogen-rich syngas from biomass and the design of oxygen carriers for pyrolysis of all-component chemical looping reforming. 展开更多
关键词 Biomass pyrolysis METHANE chemical looping reforming Oxygen carrier Kinetic analysis
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Some of the Chemical and Physical Characteristics of the Graff River in Kut City, Iraq
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作者 Salih Mahdi Ali Imad Kazem Ali 《Open Journal of Modern Hydrology》 CAS 2024年第1期56-67,共12页
Some of the chemical and physical water qualities of the Graff River in the city of Kut were studied, and for two sites of the river, One was at the Crimea site, the other in the Jihad district, and for the period fro... Some of the chemical and physical water qualities of the Graff River in the city of Kut were studied, and for two sites of the river, One was at the Crimea site, the other in the Jihad district, and for the period from October/2018 to March/2019, Seven variables of river water have been analyzed: temperature PH, electrical conductivity, TDS, turbidity, alkaline, and chloride. The results showed that most of the chemical and physical water properties of the river were in normal proportions and did not rise, except for the turbidity, which was at a very high level, and that the pH values were close to the basal side. The results of the statistical analysis revealed positive significant relationships between the pH and (chloride and TDS). On the other hand, between electrical conductivity and both previous variables as well. And a negative significant connection between temperature and alkaline. 展开更多
关键词 Graff River Kut City Iraq chemical Characteristics Physical Characteristics
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Optimizing the sulfur-resistance and activity of perovskite oxygen carrier for chemical looping dry reforming of methane
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作者 Yuelun Li Dong Tian +6 位作者 Lei jiang Huicong Zuo LiNan Huang Mingyi Chen Jianchun Zuo Hua Wang Kongzhai Li 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2024年第9期259-271,共13页
Perovskite oxides has been attracted much attention as high-performance oxygen carriers for chemical looping reforming of methane,but they are easily inactivated by the presence of trace H_(2)S.Here,we propose to modu... Perovskite oxides has been attracted much attention as high-performance oxygen carriers for chemical looping reforming of methane,but they are easily inactivated by the presence of trace H_(2)S.Here,we propose to modulate both the activity and resistance to sulfur poisoning by dual substitution of Mo and Ni ions with the Fe-sites of LaFeO_(3)perovskite.It is found that partial substitution of Ni for Fe substantially improves the activity of LaFeO_(3)perovskite,while Ni particles prefer to grow and react with H_(2)S during the long-term successive redox process,resulting in the deactivation of oxygen carriers.With the presence of Mo in LaNi_(0.05)Fe_(0.95)O_(3−σ)perovskite,H_(2)S preferentially reacts with Mo to generate MoS_(2),and then the CO_(2)oxidation can regenerate Mo via removing sulfur.In addition,Mo can inhibit the accumulation and growth of Ni,which helps to improve the redox stability of oxygen carriers.The LaNi_(0.05)Mo_(0.07)Fe_(0.88)O_(3−σ)oxygen carrier exhibits stable and excellent performance,with the CH_(4)conversion higher than 90%during the 50 redox cycles in the presence of 50 ppm H_(2)S at 800℃.This work highlights a synergistic effect in the perovskite oxides induced by dual substitution of different cations for the development of high-performance oxygen carriers with excellent sulfur tolerance. 展开更多
关键词 Perovskite oxygen carriers chemical looping reforming Sulfur-resistance Dual substitution SYNGAS
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Design method of extractant for liquid-liquid extraction based on elements and chemical bonds
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作者 Yuwen Wei Chunling Zhang +4 位作者 Yue Zhang Lili Wang Li Xia Xiaoyan Sun Shuguang Xiang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2024年第4期193-202,共10页
In the petrochemical industry process, the relative volatility between the components to be separated is close to one or the azeotrope that systems are difficult to separate. Liquid-liquid extraction is a common and e... In the petrochemical industry process, the relative volatility between the components to be separated is close to one or the azeotrope that systems are difficult to separate. Liquid-liquid extraction is a common and effective separation method, and selecting an extraction agent is the key to extraction technology research. In this paper, a design method of extractants based on elements and chemical bonds was proposed. A knowledge-based molecular design method was adopted to pre-select elements and chemical bond groups. The molecules were automatically synthesized according to specific combination rules to avoid the problem of “combination explosion” of molecules. The target properties of the extractant were set, and the extractant meeting the requirements was selected by predicting the correlation physical properties of the generated molecules. Based on the separation performance of the extractant in liquid-liquid extraction and the relative importance of each index, the fuzzy comprehensive evaluation membership function was established, the analytic hierarchy process determined the mass ratio of each index, and the consistency test results were passed. The results of case study based on quantum chemical analysis demonstrated that effective determination of extractants for the analysis of benzene-cyclohexane systems. The results unanimously prove that the method has important theoretical significance and application value. 展开更多
关键词 Molecular design Element and chemical bonds Molecular simulation THERMODYNAMICS Solvent extraction
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Edge effect during microwave plasma chemical vapor deposition diamond-film:Multiphysics simulation and experimental verification
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作者 Zhiliang Yang Kang An +7 位作者 Yuchen Liu Zhijian Guo Siwu Shao Jinlong Liu Junjun Wei Liangxian Chen Lishu Wu Chengming Li 《International Journal of Minerals,Metallurgy and Materials》 SCIE EI CAS CSCD 2024年第10期2287-2299,共13页
This study focused on the investigation of the edge effect of diamond films deposited by microwave plasma chemical vapor de-position.Substrate bulge height△h is a factor that affects the edge effect,and it was used t... This study focused on the investigation of the edge effect of diamond films deposited by microwave plasma chemical vapor de-position.Substrate bulge height△h is a factor that affects the edge effect,and it was used to simulate plasma and guide the diamond-film deposition experiments.Finite-element software COMSOL Multiphysics was used to construct a multiphysics(electromagnetic,plasma,and fluid heat transfer fields)coupling model based on electron collision reaction.Raman spectroscopy and scanning electron microscopy were performed to characterize the experimental growth and validate the model.The simulation results reflected the experimental trends observed.Plasma discharge at the edge of the substrate accelerated due to the increase in△h(△h=0-3 mm),and the values of electron density(n_(c)),molar concentration of H(C_(H)),and molar concentration of CH_(3)(C_(CH_(3)))doubled at the edge(for the special concave sample with△h=−1 mm,the active chemical groups exhibited a decreased molar concentration at the edge of the substrate).At=0-3 mm,a high diamond growth rate and a large diamond grain size were observed at the edge of the substrate,and their values increased with.The uniformity of film thickness decreased with.The Raman spectra of all samples revealed the first-order characteristic peak of dia-mond near 1332 cm^(−1).When△h=−1 mm,tensile stress occurred in all regions of the film.When△h=1-3 mm,all areas in the film ex-hibited compressive stress. 展开更多
关键词 microwave plasma chemical vapor deposition edge discharge plasma diamond film
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Engineering and Physical Bases of Development and Creation of Plasmochemical Reactors for Mobile Facilities for Medical Waste Disposal
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作者 Volodymyr Vashchenko Iryna Korduba +2 位作者 Nancy Mahmoud Al Saeed Hafez Nazarii Nehoda Serhii Tsybytovskyi 《Open Journal of Ecology》 2024年第9期651-662,共12页
This paper presents the results of the development and creation of plasma-chemical reactors for mobile and stationary installations for the destruction and disposal of solid, liquid, gaseous and mixed medical waste ba... This paper presents the results of the development and creation of plasma-chemical reactors for mobile and stationary installations for the destruction and disposal of solid, liquid, gaseous and mixed medical waste based on the domestic plasma generator PUN-1, with air as the plasma-forming gas. The design and principle of operation of plasma-chemical reactors installed on mobile experimental and industrial plants “Plazmon-1,2,3”, as well as the main features of the plasma waste disposal process are described. 展开更多
关键词 Medical Waste INCINERATION Plasma chemical Reactor Plasma Generator Mobile Installations
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