Two-Dimensional MXene as a Promising Adsorbent for Trihalomethanes Removal: A Density-Functional Theory Study

This groundbreaking research delves into the intricate molecular interactions between MXene and trihalomethanes (THs) through a comprehensive theoretical study employing density-functional theory (DFT). Trihalomethanes are common carcinogenic chlorination byproducts found in water sanitation systems...

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Bibliographic Details
Main Authors: Gomaa, Islam, Hosny, Nasser Mohammed, Elhaes, Hanan, Ezzat, Hend A., Elmahgary, Maryam G., Ibrahim, Medhat A.
Other Authors: Massachusetts Institute of Technology. Department of Chemical Engineering
Format: Article
Published: Multidisciplinary Digital Publishing Institute 2024
Subjects:
Online Access:https://hdl.handle.net/1721.1/153663