Detailed Molecular Dynamics of the Photochromic Reaction of Spiropyran: A Semiclassical Dynamics Study by Gaohong Zhai, Shuai Shao, Shaomei Wu, Yibo Lei, Yusheng Dou

“…The simulation findings provide more important complementarity for interpreting experimental observations, confirming the previously theoretical studies of photochromic ring-opening process and even supplying other possible reaction mechanisms.…”
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Adsorbate-driven dynamic active sites in stannosilicate zeolites by Xianfeng Yi, Yao Xiao, Changjiu Xia, Fengqing Liu, Yujia Liu, Yu Hui, Xin Yu, Yucai Qin, Wei Chen, Zhiqiang Liu, Lijuan Song, Anmin Zheng

“…These results provide new comprehensive insights for the fundamental understanding of the dynamic and flexible active centers and involved reaction mechanisms of novel zeolite catalysts with heterometal atoms, such as Sn, Ti, and Zr.…”
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Finite Volume Method for a Time-Dependent Convection-Diffusion-Reaction Equation with Small Parameters by Uzair Ahmed, Daoud Suleiman Mashat, Dalal Adnan Maturi

“…Convection, diffusion, and reaction mechanisms are characteristics of transient mass-transfer phenomena that occur in natural and industrial systems. …”
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Bioinspired artificial antioxidases for efficient redox homeostasis and maxillofacial bone regeneration by Ting Wang, Mingru Bai, Wei Geng, Mohsen Adeli, Ling Ye, Chong Cheng

“…Here, inspired by the reaction mechanisms of intracellular antioxidant defense systems, we propose the de novo design of an artificial antioxidase using Ru-doped layered double hydroxide (Ru-hydroxide) for efficient redox homeostasis and maxillofacial bone regeneration. …”
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A Comparative Study of the Oxygen Reduction Reaction on Pt and Ag in Alkaline Media by Alexander Rampf, Michael Braig, Stefano Passerini, Roswitha Zeis

“…This work combines the benefits of the RRDE and the GDE half‐cell to study catalysts and identify the reaction mechanisms under conditions relevant to practical fuel cells and batteries. …”
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Exergy Analysis in Hydrogen-Air Detonation by Abel Rouboa, Valter Silva, Nuno Couto

“…A seven-species and five-step global reactions mechanism is used. Implicit total variation diminishing (TVD) algorithm, based on Riemann solver, is solved. …”
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Recent catalytic advances in the production of adipic acid and its esters from bio-based C6 molecules and carbon dioxide by Dinesh Kumar Mishra, Cong Chien Truong, Yeongin Jo, Young-Woong Suh

“…The aspects of catalyst evaluation, operating conditions, and reaction mechanisms are comprehensively discussed. Last but not least, specific advices for developing novel catalytic systems and future opportunities in the sustainable production of AA and its esters are also provided.…”
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Spermine Enhances the Peroxidase Activities of Multimeric Antiparallel G-quadruplex DNAzymes by Raphael I. Adeoye, Theresia K. Ralebitso-Senior, Amanda Boddis, Amanda J. Reid, Francesca Giuntini, Amos A. Fatokun, Andrew K. Powell, Adaoha Ihekwaba-Ndibe, Sylvia O. Malomo, Femi J. Olorunniji

“…Several approaches are being used to better understand the structural basis of their reaction mechanisms, with a view to designing constructs with improved catalytic activities. …”
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Designer topological-single-atom catalysts with site-specific selectivity by Weibin Chen, Menghui Bao, Fanqi Meng, Bingbing Ma, Long Feng, Xuan Zhang, Zanlin Qiu, Song Gao, Ruiqin Zhong, Shibo Xi, Xiao Hai, Jiong Lu, Ruqiang Zou

“…Through in-situ spectroscopic characterizations combined with DFT calculations, we elucidate detailed reaction mechanisms. This study establishes T-SACs as a promising class of catalysts, offering a systematic framework to address catalytic challenges by defining site characteristics. …”
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Application of 2-Trichloromethylbenzimidazole in Analytical Chemistry: A Highly Selective Chromogenic Reagent for Thin-Layer Chromatography and Some Other Analytical Uses by Leszek Konopski, Anna Kiełczewska

“…The reaction product of TCMB and pyridine (LI Complex) was identified and fully characterized. Two different reaction mechanisms: with electron deficient basic heteroaromatic compounds, like pyridine, and with more acidic compounds, for example, pyrrole, were discussed. …”
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New Spectrophotometric and Fluorimetric Methods for Determination of Fluoxetine in Pharmaceutical Formulations by Ibrahim A. Darwish, Sawsan M. Amer, Heba H. Abdine, Lama I. Al-Rayes

“…The kinetics of the reactions were investigated, and the reaction mechanisms were presented. Under the optimum reaction conditions, good linear relationships were found between the readings and the concentrations of FLX in the ranges of 0.3–6 and 0.035–0.5 μg mL−1 for the spectrophotometric and fluorimetric methods, respectively. …”
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Total Electrosynthesis of N, N‐Dimethylformamide From CO2 and NO3− by Shuai Yan, Shuai Chen, Morgan McKee, Alexandre Terry, Ralf Weisbarth, Nikolay Kornienko

“…A prominent challenge is the limited product scope, particularly for organonitrogen chemicals featuring a variety of functional groups, alongside the limited understanding of plausible reaction mechanisms leading up to these products. In light of this, the total electrosynthesis method is reported for producing N, N‐dimethylformamide (DMF), a widespread solvent and commodity chemical, from NO3− and CO2. …”
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Phosphate valorization by dry chlorination route by Kanari N., Menad N., Diot F., Allain E., Yvon J.

“…Gathering results of the thermodynamic predictions and TG/DT analysis with those of SEM and XRD examinations of the chlorinated residues allowed the interpretation of phenomena and reactions mechanism occurring during the calcium pyrophosphate carbochlorination. …”
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In situ visualization of interfacial processes at nanoscale in non-alkaline Zn-air batteries by Jiao Wang, Shuang-Yan Lang, Zhen-Zhen Shen, Yan-Liang Zhang, Gui-Xian Liu, Yue-Xian Song, Rui-Zhi Liu, Bing Liu, Rui Wen

“…However, the dynamic evolution and reaction mechanisms regulated by electrolytes at both the positive and Zn negative electrodes remain elusive. …”
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A Comprehensive Review of Flamelet Methods: Future Directions and Emerging Challenges by Mohammed Niyasdeen Nejaamtheen, Jeong-Yeol Choi

“…These engines, characterized by highly complex flow fields, varying degrees of compressibility, and intricate chemical reaction mechanisms, present unique challenges for computational combustion models. …”
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Microscale insight into the proton concentration during electrolytic reaction via an optical microfiber: potential for microcurrent monitoring by a dielectric probe by Yunyun Huang, Jiaxuan Liang, Haotian Wu, Pengwei Chen, Aoxiang Xiao, Bai-Ou Guan

“…This approach provides a powerful complement to electrochemical methods for the elucidation of microscale reaction mechanisms. The information provided by the prepared dielectric fiber-optic sensor will shed more light on proton kinetics and electrochemical and electrobiological mechanisms, which may fill an important gap in the current bioelectricity and battery monitoring methods.…”
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The Electropolishing of C-Steel in Orthophosphoric Acid Containing Methanolic Plant Extract by Asia A. Taha, Fatma M. Abouzeid, Mohamed M. Elsadek, Yasmeen M. Othman

“…Therefore, understanding the electrochemical properties and the reaction mechanisms of the electroactive compounds from the plant extracts is necessary to further explore the mechanism and application of the plant extract-based additives for metal dissolution. …”
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Enhancing electrocatalytic performance of RuO2-based catalysts: mechanistic insights, strategic approaches, and recent advances by Binod Raj KC, Dhananjay Kumar, Bishnu Prasad Bastakoti

“…It gives a general description of water splitting in acidic and alkaline settings, including reaction mechanisms as well as common evaluation elements for the catalytic function of the materials. …”
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Biogas Production Optimization in the Anaerobic Codigestion Process: A Critical Review on Process Parameters Modeling and Simulation Tools by Mohammed Kelif Ibro, Venkata Ramayya Ancha, Dejene Beyene Lemma

“…The AcoD system involves complex chemical reactions, but AP might have limitations in representing such complex chemical processes with nonideal behavior and complicated reaction mechanisms. The design and optimization of AcoD with reliable input parameters are highly limited or nonexistent. …”
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Using ground granulated blast-furnace slag to improve the self-degradation issue of liquid calcium aluminate cement mortar by Chia-Jung Tsai, Chung-Lin Lin, Chih-Wei Lu, Wen-Shinn Shyu, Leila Fazeldehkordi

“…In addition, despite the fundamental similarity between LCAC and CAC, the significant differences in practical characteristics, including pH and reaction mechanisms, render traditional CAC methodologies less effective for LCAC. …”
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