University Chemistry ›› 2026, Vol. 41 ›› Issue (1): 213-226.doi: 10.12461/PKU.DXHX202505110

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Data-Driven Approach for the Determination of Chemical Reaction Rate Constant

Jian Huang, Mingjue Zhang, Shangchu Ma, Jia Dong, Guanzi Wu, Aiming Wen, Zhuoliang Liu   

  1. College of Science, National University of Defense Technology, Changsha 410003, China
  • Received:2025-05-30 Accepted:2025-09-23 Published:2025-12-30
  • Contact: Jian Huang, Zhuoliang Liu E-mail:huangjian2015@nudt.edu.cn;liuzhuoliang16@nudt.edu.cn

Abstract: The measurement of rate constants for the reaction between magnesium ribbon and dilute sulfuric acid constitutes a fundamental experiment in inorganic chemistry curricula across numerous universities. However, when applying first-order kinetic modeling, systematic deviations are frequently observed in the latter stage of the reaction. To examine the side-reaction hypothesis, we incorporated pH monitoring and established a standardized, automated experimental protocol with systematic data acquisition. Additionally, we developed a dedicated data processing toolkit to facilitate comprehensive analysis of the reaction kinetics in the magnesium-sulfuric acid system. The experimental analysis revealed that the main reaction (Mg with H2SO4) follows first-order kinetics, with its rate constant significantly increasing as temperature rises. In contrast, the side reaction (Mg with H2O) aligns with a second-order kinetic model, exhibiting an activation energy of 127.79 kJ‧mol‒1. Through multidimensional data integration and automated data processing workflows, this study systematically cross-validated the kinetic parameters of both main and side reactions. This approach successfully explained the experimental deviations observed in conductivity data during the reaction’s later stages. By transforming traditional verification-based experiments into a research-oriented learning platform, this work bridges the “data-driven approach” paradigm with practical laboratory instruction, providing a practical framework for cultivating innovative thinking and digital problem-solving skills among undergraduate students in non-chemistry science and engineering disciplines.

Key words: Rate constant of chemical reaction, Digital design, Data-driven research, Data processing program package