The studies on gas adsorption properties of MIL-53 series MOFs materials

The studies on gas adsorption properties of MIL-53 series MOFs materials

Molecular dynamics (MD), grand canonical Monte Carlo (GCMC) and ideal adsorbed solution theory (IAST) were used to study the structures and gas adsorption properties of MIL-53(M)[M=Cr, Fe, Sc, Al] metal organic framework (MOF) materials. The results show that the volumes of those MOF materials incre...

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Bibliographic Details
Main Authors: Yuqiu Jiao, Zhenyu Li, Yue Ma, Guanggang Zhou, Shuangxi Wang, Guiwu Lu
Format: Article
Language:English
Published: AIP Publishing LLC 2017-08-01
Series:AIP Advances
Online Access:http://dx.doi.org/10.1063/1.4999914

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