Water effect on adsorption carbon capture in metal-organic framework: A molecular simulation

Considering water vapor is a component in almost all CO2-rich industrial gas streams, it is of critical importance to understand interaction mechanisms between adsorbent and adsorbate. This paper aims to comprehensively analyze water effect on CO2 adsorption for metal-organic framework (MOF) in a br...

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Bibliographic Details

Published in:	Carbon Capture Science & Technology
Main Authors:	L. Jiang, R.Y. Xie, W.K. Shi, E.Y. Wu, B. Li, X.J. Zhang
Format:	Article
Language:	English
Published:	Elsevier 2022-09-01
Subjects:	CO2 adsorption Water effect Monte Carlo simulations Mg-MOF-74
Online Access:	http://www.sciencedirect.com/science/article/pii/S277265682200032X