Research Progress of Computation and Simulation Application in the Study of Adsorption Mechanism and Design of Metal-Organic Frameworks Materials
Lei HUANG, Qian-Wen YANG, Jing-Ling ZHANG, Fei XU, Tai YE, Xing-Fa REN, Xiu-Xiu WU
Chinese Journal of Applied Chemistry . 2023, (12): 1643 -1661 .  DOI: 10.19894/j.issn.1000-0518.230174