Special Collection: AI for Electrochemistry
Protocols
Ohmic Drop Compensation in Electrochemical Measurement
Jia-Qi Chen, Xu-Xu Ye, Ling-Wen Liao, Zhen Wei, Mian-Le Xu, and Yan-Xia Chen
A Beginners’ Guide to Modelling of Electric Double Layer under Equilibrium, Nonequilibrium and AC Conditions
Lu-Lu Zhang, Chen-Kun Li, and Jun Huang
Band Alignments of Metal/Oxides-Water Interfaces Using Ab Initio Molecular Dynamics
Yong-Bin Zhuang and Jun Cheng
Automated Workflow for Redox Potentials and Acidity Constants Calculation from Machine Learning Molecular Dynamics
Feng Wang and Jun Cheng
Reviews
Recent Advances in Electrochemical Kinetics Simulations and Their Applications in Pt-based Fuel Cells
Ji-Li Li, Ye-Fei Li, and Zhi-Pan Liu
Advances and Atomistic Insights of Electrolytes for Lithium-Ion Batteries and Beyond
Tingzheng Hou, Xiang Chen, Lu Jiang, and Cheng Tang
Application of Artificial Intelligence to Lithium-Ion Battery Research and Development
Zhen-Wei Zhu, Jing-Yi Qiu, Li Wang, Gao-Ping Cao, Xiang-Ming He, Jing Wang, and Hao Zhang
Articles
Electrostatic Interactions of Water in External Electric Field: Molecular Dynamics Simulations
Qiang ZHU, Zigui KAN, and Jing MA
Porous-Electrode Theory of Lithium Ion Battery: Old Paradigm and New Challenge
Xiao-xiao WANG, Zi-rui ZHOU, Qiang SHAN, Zeng-ming ZHANG, Jun HUANG, Yu-wen LIU, and Sheng-li CHEN
A Model for the Anodic Carbonization of Alkaline Polymer Electrolyte Fuel Cells
Qi-hao LI, Ying-ming WANG, Hua-long MA, Li XIAO, Gong-wei WANG, Jun-tao LU, and Lin ZHUANG
Theoretical Studies of Metal-N-C for Oxygen Reduction and Hydrogen Evolution Reactions in Acid and Alkaline Solutions
Xue-Ping Qin, Shang-Qian Zhu, Lu-Lu Zhang, Shu-Hui Sun, and Min-Hua Shao
Multi-Scale Simulation Revealing the Decomposition Mechanism of Electrolyte on Lithium Metal Electrode
Yan-Yan Zhang, Yue Liu, Yi-Ming Lu, Pei-Ping Yu, Wen-Xuan Du, Bing-Yun Ma, Miao Xie, Hao Yang, and Tao Cheng
Charge-Dependence of Dissolution/Deposition Energy Barrier on Cu(111) Electrode Surface by Multiscale Simulations
Hang Qiao, Yong Zhu, Sheng Sun, and Tong-Yi Zhang
Intelligent Control Based on BP Artificial Neural Network for Electrochemical Nitrate Removal
Xin-Wan Zhang, Guang-Yuan Meng, Li-Qiang Fang, Ding-ming Chang, Tong Li, Jin-Wen Hu, Peng Chen, Yong-Di Liu, and Le-Hua Zhang
