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Storage and Diffusion of Carbon Dioxide in the Metal Organic Framework MOF-5—A Semi-empirical Molecular Dynamics Study

[Image: see text] Metal–organic frameworks (MOFs) have attracted increasing attention due to their high porosity for exceptional gas storage applications. MOF-5 belongs to the family of isoreticular MOFs (IRMOFs) and consists of Zn(4)O(6+) clusters linked by 1,4-benzenedicarboxylate. Due to the larg...

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Detalles Bibliográficos
Autores principales: Listyarini, Risnita Vicky, Gamper, Jakob, Hofer, Thomas S.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10627117/
https://www.ncbi.nlm.nih.gov/pubmed/37857343
http://dx.doi.org/10.1021/acs.jpcb.3c04155