Dynamic Prediction Research of Silicon Content in Hot Metal Driven by Big Data in Blast Furnace Smelting Process under Hadoop Cloud Platform by Yang Han, Jie Li, Xiao-Lei Yang, Wei-Xing Liu, Yu-Zhu Zhang

“…Finally, the historical production big data of No. 1 blast furnace in Tangshan Iron Works II was analyzed during 2015.12.01~2016.11.30 using the reaction mechanism, control mechanism, and gray correlation model in the process of blast furnace iron-making, an essential sample set with input x1k,x2k−3,x3k−3,…,x18k,x19k−1 and output Sik+1 is constructed, and the dynamic prediction model of the content of [Si] in molten iron and the dynamic prediction model of [Si] fluctuation in the molten iron are obtained on the Hadoop platform by means of the structure and parallelized SVM solving algorithm. …”
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Thermal Methanol Synthesis from CO2 Using Cu/ZnO Catalysts: Insights from First‐Principles Calculations by Cong Xi, Yixin Nie, Hongjuan Wang, Cunku Dong, Jiuhui Han, Xi‐Wen Du

“…Cu/ZnO has long been identified as one of the most effective heterogeneous catalysts for this reaction, yet the detailed understanding of its reaction mechanism and active sites remains incomplete. …”
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Interaction of Fullerenes with Organosilanes in the Ionization Chamber of a Mass Spectrometer under Electron Impact and the Reaction of C60 with Tetraphenylsilane in Solution under... by Yury I. Lyakhovetsky, Elena A. Shilova, Alexandra P. Pleshkova, Alexander I. Belokon, Sergey O. Yakushin, Boris L. Tumanskii

“…C70 reacted with Me4Si analogously. A reaction mechanism involving homolytic dissociation of the silanes under electron impact to the corresponding organic radicals, which react further with C60 at the surface of the ionization chamber of the mass spectrometer to give the respective adducts, was offered. …”
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Novel architecture of ternary ZnO/PMA/AgI heterojunctions towards boosted visible-light photocatalytic destruction of antibiotics by Yossor R. Abdulmajeed, Saad H. Ammar, Nada D. Ali, Fatma D. Ali, A. Al-Farraji, Marwa A. Lafta

“…Accordingly, the reaction mechanism of LEV degradation over ZnO/PMA/AgI heterojunction has been elucidated and supported by active-species capturing studies, which confirm that •O2−, and in less degree h+ were the main reactive species in the reaction. …”
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Metal‐Mediated Chlorine Transfer for Molten Salt‐Driven Thermodynamic Change on Silicon Production by Minjun Je, Jin Chul Kim, Jiyeon Kim, Sungho Kim, Sunmin Ryu, Jaegeon Ryu, Sang Kyu Kwak, Soojin Park

“…Typically, Si production involves the thermochemical reduction of silicon oxides, where chloride salt additives help properly revamp the reaction mechanism. Herein, we unravel the chemical principles of molten AlCl3 salt in metallothermic reduction. …”
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Antioxidative Reactivity of L-Ascorbic Acid and D-Isoascorbic Acid Species towards Reduction of Hexachloroiridate (IV) by Han Zhang, Yanqing Xia, Peng Zhang, Liqian Hou, Ying Sun, Zhaozhan Lu, Yunfeng Tang, Hongwu Tian, Tiesheng Shi

“…Spectrophotometric titration experiments revealed a well-defined 1 : 2 stoichiometry, namely Δ[AA] : Δ[Ir(IV)] or Δ[IAA] : Δ[Ir(IV)] = 1 : 2, indicating that L-dehydroascorbic acid (DHA) and D-dehydroisoascorbic acid (DHIA) were the oxidation products of AA and IAA, respectively. A reaction mechanism is suggested involving parallel reactions of [IrCl6]2– with three protolysis species of AA/IAA (fully protonated, monoanionic, and dianionic forms) as the rate-determining steps and formation of ascorbic/isoascorbic and ascorbate/isoascorbate radicals; in each of the steps, [IrCl6]2– acquires an electron via an outer-sphere electron transfer mode. …”
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Photocatalytic production and biological activity of D-arabino-1,4-lactone from D-fructose by Sho Usuki, Pratiksha Babgonda Patil, Tiangao Jiang, Naoko Taki, Yuma Uesaka, Haru Togawa, Sanjay S. Latthe, Shanhu Liu, Kenji Yamatoya, Kazuya Nakata

“…Analysis of the reaction mechanism revealed that D-arabino-1,4-lactone can be directly produced by the α scission (C1-C2 position cleavage) of D-fructose. …”
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Photocatalytic improvement mechanism of SnO2/Sn-doped g-C3N4 Z-type heterojunctions for visible-irradiation-based destruction of organic pollutants: Experimental and RSM approaches by Yossor R. Abdulmajeed, Saad H. Ammar, Zaid H. Jabbar, Hind J. Hadi, Mohammed D. Salman, Alaa Jasim Awadh

“…Accordingly, we explored the reaction mechanism in light of trapping studies. Besides, the stability of SnO2/Sn-doped g-C3N4 hybrid photocatalyst was tested.…”
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Shock reaction model for impact energy release behavior of Al/PTFE reactive material by Bao-yue Guo, Ke-rong Ren, Xia-yin Ma, Gan Li, Cai-min Huang, Zhi-bin Li, Rong Chen

“…When used as the core of a PELE (Penetrator with Enhanced Lateral Efficiency) projectile, reactive materials can enhance the fragmentation of the projectile shell after penetrating the target, causing both physical and chemical damage. The reaction mechanism of these materials is complex, and it is difficult to directly monitor the chemical reaction process. …”
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Microbial Surface Confined Growth Strategy for the Synthesis of Highly Loaded NiCoP Nanoparticles with Hollow Derived Carbon Shells for Sodium Ion Capture by Jianhua Yuan, Tianxiao Sun, Jinfeng Chen, Runhong Zhou, Jianglin Cao, Fei Yu, Liqing Li, Xiumin Zhong, Jie Ma

“…Scanning transmission X‐ray microscopy (STXM) analysis confirmed the reversible conversion reaction mechanism and the robust structure of NiCoP@NPC before and after the reaction; Density function theory (DFT) and electrochemical quartz crystal microbalance (EQCM‐D) further confirmed that the structural design of NiCoP@NPC promoted electron transport, Na+ adsorption as well as improved cycling stability. …”
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Neural network potentials for exploring condensed phase chemical reactivity by Gomez, Axel, de la Puente, Miguel, David, Rolf, Laage, Damien

“…Recent advances in machine learning offer powerful tools for exploring complex reaction mechanisms in condensed phases via reactive simulations. …”
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Progress in the kinetics of slag-metal-gas reactions, past present and future by Coley K.S.

“…They demonstrated that the reaction interface could change dramatically under the influence of reaction and many questions were asked about the specific reaction mechanisms. This paper will review work in slag metal reactions since the mid 1980s and examine our progress in answering some of the questions raised by the early pioneers. …”
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Marine fungi as a goldmine for novel antibiotics: a 2024 perspective by Chengqian Pan, Syed Shams ul Hassan, Ishaq Muhammad, Huizi Jin

“…These factors contribute to significant distinctions in secondary metabolic pathways and enzymatic reaction mechanisms between marine and terrestrial microorganisms. …”
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In situ and operando characterization techniques for nanocatalyst-based electrochemical hydrogen evolution reactions by Anaclet Nsabimana, Yiran Guan, Guobao Xu

“…Understanding the status of the catalysts and reaction mechanisms motivated researchers to adopt the operando/in situ techniques. …”
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Electrochemical conversion of small organic molecules to value-added chemicals and hydrogen/electricity without CO2 emission: Electrocatalysts, devices and mechanisms by Jianwen Liu, Guodong Fu, Yuanfeng Liao, Wangji Zhang, Xiuan Xi, Fengzhan Si, Lei Wang, Jiujun Zhang, Xian-Zhu Fu, Jing-Li Luo

“…In this review, the advances in the design of electrocatalysts, fabrication of devices, and understanding of reaction mechanisms are comprehensively summarized and analyzed. …”
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Estimation of the Occurrence Time of Thaumasite Sulfate Attack on Tunnel Lining Concrete by Chongbang Xu, Xiaojing Gao, Xuefeng Li, Kaishun Zhang

“…Previous investigations on the formation of thaumasite were focused on identifying the deterioration products and reaction mechanisms, while the occurrence time of TSA on tunnel concrete structures was not reported. …”
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How the Interpretation of Drivers' Behavior in Virtual Environment Can Become a Road Design Tool: A Case Study by Marco Pasetto, Stefano Damiano Barbati

“…The paper describes a research, based on real and virtual environment surveys, aimed to better understand drivers' action-reaction mechanisms inside different scenarios, in order to gain informations useful for a correct organization (design) of the road space. …”
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Graph-theoretic conditions for zero-eigenvalue Turing instability in general chemical reaction networks by Maya Mincheva, Gheorghe Craciun

“…., Turing instability arising from a real eigenvalue changing sign from negative to positive, for general chemical reaction networks modeled with mass-action kinetics. The reaction mechanisms are represented by the species-reaction graph (SR graph), which is a bipartite graph with different nodes representing species and reactions. …”
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Research progress on preparation methods of polyvinylidene by Lijuan YAN, Yajing XUN, Kunru MA, Yunlan SUN

“…Their preparation principles, application scenarios, advantages and disadvantages were described, the challenges of PVDF modified energetic materials were further pointed out, and the key directions for future research were proposed:1) safety improvements; 2) green technologies; 3) nanomaterial optimisation; 4) multi-scale design; 5) innovative coating methods; and 6) insight into reaction mechanisms.…”
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Microdosimetry test on double layer beam shaping assembly neutron beam as a boron neutron capture therapy neutron source using PHITS code by Bilalodin, A. Haryadi, Sehah, Zusfahair, Y. Sardjono, R. Tursinah

“…The simulation results show that the interaction of neutrons with microcells occurs through scattering, reflection, and absorption reaction mechanisms. The results of the microdosimetry test showed that the peak LET value of α-particles was 100 keV/μm and 7Li was 200 keV/μm, with an RBE value for α of 9.83 and 7Li of 6.11.…”
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