Tailoring zirconium-based metal organic frameworks for enhancing hydrophilic/hydrophobic characteristics: simulation and experimental investigation

Tailoring zirconium-based metal organic frameworks for enhancing hydrophilic/hydrophobic characteristics: simulation and experimental investigation

This article focuses on Grand Canonical Monte Carlo (GCMC) simulation to tailor zirconium-based metal organic frameworks (MOFs) such as UiO-66 (Zr) and MOF-801(Zr). The hydrophilic functional group such as amine (–NH2), hydroxyl (–OH) and pyridine (-C5H5N) and the hydrophobic functional group such a...

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Bibliographic Details
Main Authors: Han, Bo, Chakraborty, Anutosh
Other Authors: School of Mechanical and Aerospace Engineering
Format: Article
Language:English
Published: 2022
Subjects:
Engineering::Mechanical engineering
Adsorption
GCMC Simulation
Online Access:https://hdl.handle.net/10356/159945
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Institution: Nanyang Technological University
Language: English

Internet

https://hdl.handle.net/10356/159945

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