详细信息

Fluid Interface Thermodynamics Software: From Theory to Instruction  ( SCI-EXPANDED收录)  

文献类型:期刊文献

英文题名:Fluid Interface Thermodynamics Software: From Theory to Instruction

作者:Wang, Qing[1];Cheng, Jin[1];Li, Baorong[1];Wang, Sijie[1];Lin, Yiting[1,3];Tao, Haolan[1];Xu, Zheng[1];Hu, Yuanlong[2];Zhu, Mingyang[1];Zhao, Hongtu[1];Wang, Jie[1,4];Zhang, Wenqing[1,2];Lian, Cheng[1,2];Liu, Honglai[1,2]

机构:[1]East China Univ Sci & Technol, Shanghai Engn Res Ctr Hierarch Nanomat, Frontiers Sci Ctr Materiobiol & Dynam Chem, Sch Chem & Mol Engn,State Key Lab Chem Engn & Low, Shanghai 200237, Peoples R China;[2]East China Univ Sci & Technol, Sch Chem Engn, Shanghai 200237, Peoples R China;[3]East China Univ Sci & Technol, Sch Mech & Power Engn, Shanghai 200237, Peoples R China;[4]East China Univ Sci & Technol, Expt Chem Ctr, Shanghai 200237, Peoples R China

年份:2025

卷号:102

期号:8

起止页码:3623

外文期刊名:JOURNAL OF CHEMICAL EDUCATION

收录:;WOS:【SCI-EXPANDED(收录号:WOS:001538771200001)】;

基金:This work was sponsored by the National Key Research and Development Program of China (No. 2022YFA1503501), the National Natural Science Foundation of China (No. 22278127, 12447149), the State Key Laboratory of Clean Energy Utilization (Open Fund Project No. ZJUCEU2021005), the Fundamental Research Funds for the Central Universities (No. 2022ZFJH004) and 21C Innovation Laboratory, Contemporary Amperex Technology Ltd by project No. 21C-368 OP-202312. The authors declare no competing financial interest.

语种:英文

外文关键词:Fluid Interface; Electrical Double Layer; MolecularThermodynamics; Electrochemistry; Upper-DivisionUndergraduate; Physical Chemistry; Computer-BasedLearning; Computational Chemistry

摘要:The structure and properties of solid-liquid interfaces have long been central topics in interfacial science, and various theoretical methods have been developed to accurately describe the species therein. However, many of these approaches remain complex and difficult to implement in educational contexts. Herein, we present a web-based software platform for fluid interface thermodynamics that features a user-friendly graphical interface specifically designed for educational use. The platform integrates several widely used computational models, including Poisson-Boltzmann, Poisson-Nernst-Planck, and classical density functional theory. This study aims to support the teaching and learning of interfacial phenomena by allowing students, particularly those without programming experience, to effectively interact with and explore fluid interface simulations.

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