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Reaction process optimization based on interpretable machine learning and metaheuristic optimization algorithms
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作者 Dian Zhang Bo Ouyang Zheng-Hong Luo 《Chinese Journal of Chemical Engineering》 2025年第8期77-85,共9页
The optimization of reaction processes is crucial for the green, efficient, and sustainable development of the chemical industry. However, how to address the problems posed by multiple variables, nonlinearities, and u... The optimization of reaction processes is crucial for the green, efficient, and sustainable development of the chemical industry. However, how to address the problems posed by multiple variables, nonlinearities, and uncertainties during optimization remains a formidable challenge. In this study, a strategy combining interpretable machine learning with metaheuristic optimization algorithms is employed to optimize the reaction process. First, experimental data from a biodiesel production process are collected to establish a database. These data are then used to construct a predictive model based on artificial neural network (ANN) models. Subsequently, interpretable machine learning techniques are applied for quantitative analysis and verification of the model. Finally, four metaheuristic optimization algorithms are coupled with the ANN model to achieve the desired optimization. The research results show that the methanol: palm fatty acid distillate (PFAD) molar ratio contributes the most to the reaction outcome, accounting for 41%. The ANN-simulated annealing (SA) hybrid method is more suitable for this optimization, and the optimal process parameters are a catalyst concentration of 3.00% (mass), a methanol: PFAD molar ratio of 8.67, and a reaction time of 30 min. This study provides deeper insights into reaction process optimization, which will facilitate future applications in various reaction optimization processes. 展开更多
关键词 reaction process optimization Interpretable machine learning Metaheuristic optimization algorithm BIODIESEL
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Reaction Process of Chromium Slag Reduced by Industrial Waste in Solid Phase 被引量:8
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作者 SHI Yu-min DU Xing-hong +2 位作者 MENG Qing-jia SONG Shi-wei SUI Zhi-tong 《Journal of Iron and Steel Research International》 SCIE EI CAS CSCD 2007年第1期12-15,共4页
M, a particular industrial waste, was selected to detoxify chromium slag at a high temperature. The carbon remaining in M reduced Cr ( Ⅳ ) of Na2 CrO4 borne in the chromium slag to Cr ( Ⅲ ) in the solid phase re... M, a particular industrial waste, was selected to detoxify chromium slag at a high temperature. The carbon remaining in M reduced Cr ( Ⅳ ) of Na2 CrO4 borne in the chromium slag to Cr ( Ⅲ ) in the solid phase reaction, and its thermodynamics and kinetics were studied. The reduction process of Na2CrO4 by carbon produced CO, whiCh'was endothermic. Under the experimental condition, the apparent activation energy was 4. 41 kJ·mol^-1 , the'apparent order of reaction for Na2 CrO4 was equal to one, and the partial pressure of CO was only 0.22 Pa at 1 330℃. 展开更多
关键词 chromium slag industrial waste reduction reaction solid phase reaction process
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DBU-based CO2 absorption-mineralization system: Reaction process,feasibility and process intensification 被引量:5
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作者 Cong Luo Kejing Wu +5 位作者 Hairong Yue Yingying Liu Yingming Zhu Wei Jiang Houfang Lu Bin Liang 《Chinese Journal of Chemical Engineering》 SCIE EI CAS CSCD 2020年第4期1145-1155,共11页
Amine-based carbon dioxide(CO2)capture is still limited by high desorption energy consumption.Fixing CO2 into carbonate is a safer and more permanent method.In this work,calcium oxide(CaO)is introduced to perform chem... Amine-based carbon dioxide(CO2)capture is still limited by high desorption energy consumption.Fixing CO2 into carbonate is a safer and more permanent method.In this work,calcium oxide(CaO)is introduced to perform chemical desorption instead of thermal desorption on 1,8-diazabicyclo[5.4.0]undec-7-ene(DBU)aqueous solution after CO2 absorption.The X-ray diffraction(XRD)patterns of solid products show the formation of calcite calcium carbonate(CaCO3),which prove the feasibility of this method.The effects of reaction temperature,reaction time and Ca2+/CO32-molar ratios on the related reactions in CO2 absorption-mineralization process and CaCO3 precipitation are discussed,and purer CaCO3 is obtained by ultrasonic treatment.The CaCO3 content can be increased to 95.8%and the CO2 desorption ratio can achieve 80%by 30 min ultrasonic dispersion treatment under the conditions(40℃,180 min,Ca2+/CO32-molar ratio=1.0).After five cycles,DBU aqueous solution shows stable CO2 absorption and mineralization ability.Fourier transform infrared spectroscopy(FT-IR)spectra of the reaction process also indicate the regeneration of the solvent.Compared with thermal desorption,this process is exothermic,almost without no additional heat. 展开更多
关键词 CO2 mineralization CACO3 1 8-Diazabicyclo[5.4.0]undec-7-ene aqueous reaction process
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Kinetic role of Cu content in reaction process, behavior and their relationship among Cu-Zr-C system
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作者 Qiaodan Hu Xianrui Zhao +4 位作者 Siyu Sun Hua Zheng Sheng Cao Jianguo Li Mengxian Zhang 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2019年第10期2375-2382,共8页
The influence of Cu content on the reaction process, reaction behavior and obtained products in the Cu-ZrC system, as well as their relationships, were investigated. The results showed that Zr C was synthesized throug... The influence of Cu content on the reaction process, reaction behavior and obtained products in the Cu-ZrC system, as well as their relationships, were investigated. The results showed that Zr C was synthesized through the diffusion and dissolution of C into a Cu-Zr liquid. Increasing the Cu content enhanced the amount of Cu-Zr liquid formed at the early stage but decreased the amount of C atoms dissolving into the melt at unit time. Consequently, the ignition time initially decreased and then increased. Conversely, with an increased Cu content, the energy required for igniting the neighboring unreacted powders increased,while the heat released by the reaction and the dwell time of the compact at high temperatures decreased.These effects then resulted in the reduction of combustion wave velocity, combustion temperature and Zr C particle size. Furthermore, the synthesis of ZrC is a multistage process, which provides a nonuniform distributed Zr C particle size. The sub-μm Zr C particle reinforced Cu matrix composite was fabricated by adding a ZrC-Cu master alloy prepared through a self-propagating high-temperature synthesis reaction into liquid Cu. 展开更多
关键词 Self-propagating high-temperature synthesis reaction process reaction BEHAVIOR SOLIDIFICATION
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Research progress of the Maillard reaction process monitoring
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作者 Ziwang Liu Xiaoqian Wang +5 位作者 Honglin Qin Yan Chen Ling Xia Xuanjing Wang Yanhua Lai Gongke Li 《Chinese Chemical Letters》 2026年第4期211-224,共14页
The Maillard reaction(non-enzymatic browning reaction)is a complex reaction between carbonyl compounds such as reducing sugars,aldehydes and ketones and compounds containing free amino groups such as amino acids,pepti... The Maillard reaction(non-enzymatic browning reaction)is a complex reaction between carbonyl compounds such as reducing sugars,aldehydes and ketones and compounds containing free amino groups such as amino acids,peptides and proteins.This reaction not only affects product sensory qualities,but may also generate harmful substances such as acrylamide,polycyclic aromatic hydrocarbons,and advanced glycation end-products.These substances pose various health risks to humans,including carcinogenicity,neurotoxicity and diabetes mellitus.Therefore,monitoring the Maillard reaction process and precisely controlling reaction conditions are crucial for understanding its mechanism,optimizing product quality and ensuring product safety.This review systematically summarizes recent advancements in Maillard reaction research,outlining its fundamental processes and key influencing conditions,laying a foundation for the study of the monitoring methods of Maillard reaction process.Additionally,this review takes a cross-industry perspective to explore the applications of Maillard reaction monitoring methods(spectroscopic methods,chromatography/chromatography-mass spectrometry,electrochemical methods and nuclear magnetic resonance and enzyme linked immunosorbent assay)in various fields,including food industry,tobacco processing,biopharmaceuticals,materials science and textile dyeing.Through cross-industry applications,the challenges of monitoring the Maillard reaction process are analyzed,including the diversity of reaction products,complexity of sample preparation,and real-time monitoring.Future prospects are proposed through the challenges,including the development of advanced nanomaterials and biosensors,and the integration of machine learning into predictive modeling of reaction kinetics for application in industrial processes.The review aiming to provide valuable references and guidance for industrial safety production and process condition optimization. 展开更多
关键词 Maillard reaction process Advanced glycation end-products reaction condition control Monitoring methods Product safety
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Identifying Chemical Reaction Processes by Machine Learned Spectroscopy
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作者 Yucheng He Jun Jiang +1 位作者 Yan Huang Song Wang 《CCS Chemistry》 2025年第8期2315-2324,共10页
Identifying chemical reaction processes is essential for exploring the mechanism and optimizing the reaction.In situ spectroscopy can provide real-time information on molecules during chemical reactions to help reveal... Identifying chemical reaction processes is essential for exploring the mechanism and optimizing the reaction.In situ spectroscopy can provide real-time information on molecules during chemical reactions to help reveal the reaction mechanism and dynamics.However,it is time-consuming and laborious to observe and decipher the spectra manually,and it is difficult for humans to capture the subtle differences between spectra,which makes it difficult to do quantitative analysis.The noise of the reaction systems also poses a greater challenge.Herein,we employed a combination of machine learning(ML)and spectroscopic techniques to establish a correlation between spectroscopic data and the processes of the carbon dioxide reduction reaction.By intelligently resolving the vibrational spectral signals,we can accurately identify the individual steps of the reaction.With a small amount of additional data,the approach is not only applicable to different systems,but also maintains good performance in noisy environments.Furthermore,we establish the spectrastructure quantitative relationship to obtain more refined reaction coordinates.Identifying chemical reaction processes using such an ML framework lays the foundation for unraveling the black box of chemical reactions between reactants and products,and provides a new strategy for understanding and optimizing chemical reactions. 展开更多
关键词 SPECTRUM reaction process machine learning classification spectra-structure relationship
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Preparation of β-Sialon/ZrN bonded corundum composites from zircon by nitridation reaction sintering process 被引量:4
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作者 马北越 于景坤 +1 位作者 刘涛 颜正国 《Journal of Central South University》 SCIE EI CAS 2009年第5期725-729,共5页
β-Sialon/ZrN bonded corundum composites were synthesized using fused white corundum,alumina micro powder,zircon and carbon black by nitridation reaction sintering process. Phase composition and microstructure of the ... β-Sialon/ZrN bonded corundum composites were synthesized using fused white corundum,alumina micro powder,zircon and carbon black by nitridation reaction sintering process. Phase composition and microstructure of the synthesized composites were investigated by X-ray powder diffraction and scanning electronic microscope,and the formation process of the composites was discussed. The results show that the composites with different compositions can be obtained by controlling the heating temperature and contents of zircon and carbon black. The proper temperature to synthesize the composites is 1773 K. 展开更多
关键词 Β-SIALON ZRN ZIRCON CORUNDUM COMPOSITES nitridation reaction sintering process
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Effects of Solid-State Reaction Synthesis Processing Parameters on Thermoelectric Properties of Mg_2Si 被引量:2
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作者 姜洪义 《Journal of Wuhan University of Technology(Materials Science)》 SCIE EI CAS 2004年第2期55-56,共2页
The Mg_(2)Si-matrix thermoelectric material was synthesized by low temperature solid-state reaction.This paper studies the effects of holding time and reaction temperature on the particle size and the properties of th... The Mg_(2)Si-matrix thermoelectric material was synthesized by low temperature solid-state reaction.This paper studies the effects of holding time and reaction temperature on the particle size and the properties of the material,and also studies effects of doping elemental Sb,Te and their doping seqence on the properties of the material.The result shows that excessively high temperature and elongated holding time of solid-state reaction are harmful,there is a range of particle size to ensure optimum properties and the doping sequence of Sb or Te without influencing the properties. 展开更多
关键词 solid-state reaction processing parameters Mg_2Si based compounds
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EFFECT OF STRESS-INDUCED REACTIONS ON MORPHOLOGICAL STRUCTURE AND PROCESSABILITY OF PVC DURING PAN-MILLING 被引量:1
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作者 Hua-weiZou WenXu Qing-fenFeng XiXu 《Chinese Journal of Polymer Science》 SCIE CAS CSCD 2005年第2期227-234,共8页
The effect of pan-milling on morphological structure,processability and properties of PVC was studied throughSEM,FTIR,granulometer,GPC and mechanical properties test in the hope of gaining ease in operation,needless o... The effect of pan-milling on morphological structure,processability and properties of PVC was studied throughSEM,FTIR,granulometer,GPC and mechanical properties test in the hope of gaining ease in operation,needless ofplasticizers,a clean and efficient route for improving the processability of PVC through stress-induced reactions,fulfilling the idea of“plasticizing PVC by itself”.The experimental results show that during pan-milling at ambienttemperature,within 2-3 min,the microcrystalline structure of PVC becomes indistinct,the grain size of PVC is reducedfrom 130-160 μm to 1-50 μm the molecular weight of PVC is slightly decreased,the variation of molecular weightdistribution is indistinct,the plasticizing time and torque at balance drop a great deal from 71-132 s to 31-33 s and from18.2-22.1 Nm to 14.7-18.4 Nm,respectively,the processability of PVC is markedly improved,and the mechanicalproperties get enhanced too. 展开更多
关键词 Poly(vinyl chloride) Stress-induced reaction Morphological structure processability.
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The influence of intimacy on the ’iterative reactions’ during OX-ZEO process for aromatic production 被引量:6
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作者 Xiaoli Yang Ting Sun +6 位作者 Junguo Ma Xiong Su Ruifeng Wang Yaru Zhang Hongmin Duan Yanqiang Huang Tao Zhang 《Journal of Energy Chemistry》 SCIE EI CAS CSCD 2019年第8期60-65,I0003,共7页
The oxide-zeolite process provides a promising way for one-step production of aromatics from syngas,whereas the reasons for the dramatic effect of intimacy between oxide and zeolite in the composite catalyst on the pr... The oxide-zeolite process provides a promising way for one-step production of aromatics from syngas,whereas the reasons for the dramatic effect of intimacy between oxide and zeolite in the composite catalyst on the product selectivity are still unclear. In order to explore the optimal intimacy and the essential influence factors, ZnCrOxcombined with ZSM-5 are employed to prepare the composite catalysts with different distances between the two components by changing the mixing methods. An aromatic selectivity of 74%(with CO conversion to be 16%) is achieved by the composite catalyst when the intimacy is in the range of nanometer. A so-called ‘iterative reactions’ mechanism of intermediates over oxides is then proposed and studied: the intermediate chemical can undergo a hydrogenation reaction on oxide.So the shorter the intermediates stay on oxide, the more of chance for C-C coupling takes place on zeolite to form aromatics. Moreover, the aero-environments of reaction is found to impact on the extent of iterative reaction as well. Therefore, when the intimacy between the two components changes, the extent of iterative reactions vary, resulting in alteration of product distribution. This work provides new insight in understanding the mechanisms during the complex process of OX-ZEO composite catalysis and sheds light to the design of a high-yield catalyst for synthetization of aromatics from syngas. 展开更多
关键词 OX-ZEO process INTIMACY ITERATIVE reactionS reaction aero-environment Diffusion
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Electrochemical and Reaction Bonding Processing of Thick ZrO_2/Al_2O_3 Composite Coatings
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作者 WANGZhou-cheng XIAOPing 《材料热处理学报》 EI CAS CSCD 北大核心 2004年第05B期1068-1071,共4页
A novel technique combining electrophoretic deposition (EPD) and reaction bonding process (RBP) is developed to fabricate thick ZrO2/Al2O3 composite coatings. Mixed organic solvents are used here to make suspension co... A novel technique combining electrophoretic deposition (EPD) and reaction bonding process (RBP) is developed to fabricate thick ZrO2/Al2O3 composite coatings. Mixed organic solvents are used here to make suspension containing yttria stablised zirconia (YSZ) and aluminium (Al). The results show that densely packed green form coatings are deposited using a mixture of ethanol and acetylacetone as suspension medium and ball milling for 48 hours. On subsequent heat treatment, melting and oxidation of aluminium in the green forms promote densification during sintering. By these means, thick, uniform and crack-free ZrtVA^Oa composite coatings have been fabricated on metal substrate. 展开更多
关键词 电泳沉积 复合涂层 ZRO2 AL2O3 RBP
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Metallurgical Reaction Characteristic for the Combined Blowing Process of Top-Bottom Blown Oxygen and Bottom Blown Natural Gas
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作者 颜广庭 唐萍 张淑筠 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 1991年第1期50-54,共5页
The experiment was carried out in a combined blowing converter.The natural gas was supplied as the cooling medium for the bottom lance.The blow- ing practice of medium P hot metal (0.30-0.85% [P]) indicated that with ... The experiment was carried out in a combined blowing converter.The natural gas was supplied as the cooling medium for the bottom lance.The blow- ing practice of medium P hot metal (0.30-0.85% [P]) indicated that with better stirring at the bottom of the converter and lower P_(CO),this steelmgking process was favorable to reduce the amount of [C] and [O] and increase the (P_2O_5)/[P]. The maximum rate of dephospborization might be high up to 0.0a5%/min and the P content in steel could be reduced to lower than 0.03% by single slag-forming operation. 展开更多
关键词 combined blowing process metallurgical reaction oxygen blowing
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Implementation of Process Reaction Curve for Tuning of Temperature Control Parameters in a 10 L Stirred Tank Heater
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作者 Yulius Deddy Hermawan 《材料科学与工程(中英文A版)》 2011年第4X期572-577,共6页
关键词 电加热器 温度上升 反应曲线 调整参数 控制参数 搅拌槽 积分时间常数 PID控制
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Effects of reaction parameters on preparation of Cu nanoparticles via aqueous solution reduction method with NaBH_4 被引量:1
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作者 刘清明 周德璧 +2 位作者 Yu-ya YAMAMOTO Kensuke KURUDA Masazumi OKIDO 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2012年第12期2991-2996,共6页
The preparation of Cu nanoparticles by the aqueous solution reduction method was investigated. The effects of different reaction parameters on the preparation of Cu nanoparticles were studied. The optimum conditions f... The preparation of Cu nanoparticles by the aqueous solution reduction method was investigated. The effects of different reaction parameters on the preparation of Cu nanoparticles were studied. The optimum conditions for preparing well-dispersed nanoparticles were found as follows: 0.4 mol/L NaBH4 was added into solution containing 0.2 mol/L Cu2+, 1.0% gelatin dispersant in mass fraction, and 1.2 mol/L NH3?H2O at pH 12 and 313 K. In addition, a series of experiments were performed to discover the reaction process. NH3?H2O was found to be able to modulate the reaction process. At pH=10, Cu2+ was transformed to Cu(NH3)42+ as precursor after the addition of NH3?H2O, and then Cu(NH3)42+ was reduced by NaBH4 solution. At pH=12, Cu2+ was transformed to Cu(OH)2 as precursor after the addition of NH3?H2O, and Cu(OH)2 was then reduced by NaBH4 solution. 展开更多
关键词 Cu nanoparticles NABH4 CU(OH)2 Cu(NH3)42+ aqueous solution reduction method PRECURSOR reaction process
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化工传递过程中的欧几里得空间、分形几何对称空间及其应用
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作者 段毅文 胡瑞生 +2 位作者 刘全生 陈丽萍 斯琴达赖 《内蒙古石油化工》 2026年第2期18-22,共5页
经典科学的问题总在欧几里德空间(例如:无限平面形成的矩形空间、无限柱体或/和球体…)中讨论,但真实世界并不总像在欧几里德空间里那么完美,它们总是千疮百孔且离理想、完美的形态甚远。因此,我们应该采用一个非欧几里德空间中更准确... 经典科学的问题总在欧几里德空间(例如:无限平面形成的矩形空间、无限柱体或/和球体…)中讨论,但真实世界并不总像在欧几里德空间里那么完美,它们总是千疮百孔且离理想、完美的形态甚远。因此,我们应该采用一个非欧几里德空间中更准确的方法来描述这些真实问题,分形几何对称模型已经被提出、并被用于讨论这类真实问题。 展开更多
关键词 动量传递 热量传递 质量传递 欧几里德空间 非欧几里德空间 分形几何对称空间 固体颗粒催化剂 催化反应过程
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超低温下热力学系统的化学亲和势和反应热
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作者 周颖慧 赵英汝 +1 位作者 苏国珍 陈金灿 《物理与工程》 2026年第1期65-69,共5页
化学亲和势和反应热是研究低温化学反应的热力学系统性能的两个重要参数。本文阐明对于仅包含体变功的热力学系统,这两个参数在可逆等温等压过程中可由热力学理论算出均为零;而这两个参数在不可逆等温等压过程中必须由实验测定,具体数... 化学亲和势和反应热是研究低温化学反应的热力学系统性能的两个重要参数。本文阐明对于仅包含体变功的热力学系统,这两个参数在可逆等温等压过程中可由热力学理论算出均为零;而这两个参数在不可逆等温等压过程中必须由实验测定,具体数值依赖于等温等压过程的不可逆程度,但它们之间的关系可应用热力学理论进行讨论;当温度为绝对零度时,这两个参数均为零。教科书和文献中给出的一些算例是值得商榷的。 展开更多
关键词 化学亲和势 反应热 化学反应 等温等压过程 热力学
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蒸煮加工过程中糖化反应对Ⅰ型牛胶原蛋白结构的影响规律
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作者 张越华 梁兰兰 +2 位作者 杨逸鹏 婺鸣 李冰 《广州城市职业学院学报》 2026年第1期77-85,共9页
Ⅰ型牛胶原蛋白在热加工过程中被糖化后会造成营养损失、、成胶性能下降,甚至危害健康。为明晰BC-Ⅰ的糖化规律,本研究考察了98℃和115℃下BC-Ⅰ被葡萄糖、蔗糖、直链淀粉、支链淀粉四种糖类糖化后其结构的变化规律。结果表明四种糖均... Ⅰ型牛胶原蛋白在热加工过程中被糖化后会造成营养损失、、成胶性能下降,甚至危害健康。为明晰BC-Ⅰ的糖化规律,本研究考察了98℃和115℃下BC-Ⅰ被葡萄糖、蔗糖、直链淀粉、支链淀粉四种糖类糖化后其结构的变化规律。结果表明四种糖均可糖化BC-Ⅰ,引起蛋白荧光发射峰红移(382 nm至386 nm),荧光强度增加(最高达13倍),但BC-Ⅰ二级结构变化不显著;各糖类的糖化效果排序为葡萄糖>蔗糖>直链淀粉>支链淀粉。在一级结构上,葡萄糖和蔗糖糖化BC-Ⅰ后游离氨基含量显著变化,分别降低60%和40%以上;葡萄糖糖化BC-Ⅰ还导致游离巯基含量降低20%以上。此外,葡萄糖与直链淀粉糖化BC-Ⅰ的表面疏水性(H0值)增加,6 h加热后约为原蛋白1.8倍,但蔗糖、支链淀粉对H0值影响不显著。结合荧光光谱结果,推测与加热过程中BC-Ⅰ的展开行为有关,葡萄糖与直链淀粉糖化的BC-Ⅰ可能形成了熔球态。研究表明糖种类是BC-Ⅰ糖化反应的重要控制点,其中小分子糖如葡萄糖和蔗糖是重要底物;葡萄糖和直链淀粉还有助于控制BC-Ⅰ熔球态的出现,有助于弥补热加工过程导致的功能特性损失。该结果为蒸煮加工中调控BC-Ⅰ糖化程度和功能性提供了指导。 展开更多
关键词 Ⅰ型牛胶原蛋白(BC-Ⅰ) 蒸煮加工 糖化反应 多级结构
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IN SITU PROCESSING OF Al_(2)O_(3) WHISKERS REINFORCED Ti-Al INTERMETALLIC COMPOSITES 被引量:6
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作者 F.Wang Z.K.Fan J.F.Zhu 《Acta Metallurgica Sinica(English Letters)》 SCIE EI CAS CSCD 2006年第6期432-440,共9页
In situ Al2O3 whiskers reinforced Ti-Al intermetallic composites were fabricated at ~1200℃ by reaction sintering of cold-consolidated fillets consisting mainly of Ti, Al, and different additives. The phases and micro... In situ Al2O3 whiskers reinforced Ti-Al intermetallic composites were fabricated at ~1200℃ by reaction sintering of cold-consolidated fillets consisting mainly of Ti, Al, and different additives. The phases and microstructures of the sintered composites were characterized using X-ray diffraction (XRD) and scanning electron microscopy (SEM) coupled with energy dispersive spectroscopy (EDS). The process of synthesis was investigated using differential thermal analysis (DTA). The effects of processing parameters and additives on the microstructures of the composites and the development of whisker were examined. It is found that the morphology of the whisker is strongly influenced by the additives, the exothermal reaction process, and the processing parameters. 展开更多
关键词 in situ Al2O3 whisker Ti-Al intermetallic composite ADDITIVE reaction process
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面向低碳化工的合成气氢碳比调控技术研究进展
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作者 顾成 刘雨欣 +2 位作者 张金鹏 荆洁颖 李文英 《洁净煤技术》 北大核心 2026年第1期245-261,共17页
合成气中氢碳物质的量比(n(H_(2))/n(CO))的精准调控是实现高附加值化学品高效制备的关键因素,也是煤化工及相关过程低碳转型的核心技术之一,直接决定下游化学品合成工艺的生产效率、能耗及碳排放。传统的水煤气变换反应(Water–Gas Shi... 合成气中氢碳物质的量比(n(H_(2))/n(CO))的精准调控是实现高附加值化学品高效制备的关键因素,也是煤化工及相关过程低碳转型的核心技术之一,直接决定下游化学品合成工艺的生产效率、能耗及碳排放。传统的水煤气变换反应(Water–Gas Shift reaction,WGS)作为最常用的合成气n(H_(2))/n(CO)调控手段,虽然工艺成熟,但受限于反应热力学平衡与催化剂稳定性等瓶颈,并且在反应过程中会不可避免地产生额外CO_(2)。为突破传统n(H_(2))/n(CO)调控工艺的局限,从多元化角度阐述了合成气n(H_(2))/n(CO)调控策略:外源氢气引入可实现快速而精确的n(H_(2))/n(CO)调节,但该方案在大规模应用中仍受限于制氢成本与基础设施建设;新兴短流程催化技术(如CO_(2)电催化、光催化)可在反应过程中直接生成具有定制化n(H_(2))/n(CO)的合成气,但目前该方案合成气产量与工业生产对合成气需求量不匹配;过程强化与系统耦合(如多重整耦合、吸附强化水煤气变换、膜反应器耦合、生物质气化集成吸附强化水煤气变换与逆Boudouard反应、共气化等)通过多反应协同、反应生成物原位移除、反应路径集成和原料互补等途径,实现了合成气生产与n(H_(2))/n(CO)调控以及能效提升与碳减排的协同。通过整体分析发现,合成气n(H_(2))/n(CO)调控技术正从“单元优化”向“系统集成协调优化”转变,为构建低碳化、短流程、高灵活性的绿色合成气生产加工利用平台提供支撑,并对实现“双碳”目标具有重要意义。 展开更多
关键词 合成气 氢碳比 水煤气变换反应 过程强化 低碳化
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Reaction mechanism of roasting Zn_2SiO_4 using NaOH 被引量:4
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作者 Xiao-yi SHEN Hong-mei SHAO +3 位作者 Hui-min GU Bing CHEN Yu-chun ZHAI Pei-hua MA 《Transactions of Nonferrous Metals Society of China》 SCIE EI CAS CSCD 2018年第9期1878-1886,共9页
The reaction kinetics of roasting zinc silicate using NaOH was investigated.The orthogonal test was employed to optimize the reaction conditions and the optimized reaction conditions were as follows:molar ratio of NaO... The reaction kinetics of roasting zinc silicate using NaOH was investigated.The orthogonal test was employed to optimize the reaction conditions and the optimized reaction conditions were as follows:molar ratio of NaOH to Zn2SiO4 of 16:1,reaction temperature of 550°C,and reaction time of 2.5 h.In order to ascertain the phases transformation and reaction processes of zinc oxide and silica,the XRD phase analysis was used to analyze the phases of these specimens roasted at different temperatures.The final phases of the specimen roasted at 600°C were Na2ZnO2,Na4SiO4,Na2ZnSiO4 and NaOH.The reaction kinetic equation of roasting was determined by the shrinking unreacted core model.Aiming to investigate the reaction mechanism,two control models of reaction rate were applied:chemical reaction at the particle surface and diffusion through the product layer.The results indicated that the diffusion through the product layer model described the reaction process well.The apparent activation energy of the roasting was 19.77 kJ/mol. 展开更多
关键词 reaction mechanism KINETICS Zn2SiO4 NaOH roasting reaction process phase transformation
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