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Computational investigation of hysteresis and phase equilibria of n-alkanes in a metal-organic framework with both micropores and mesopores

Adsorption hysteresis is a phenomenon related to phase transitions that can impact applications such as gas storage and separations in porous materials. Computational approaches can greatly facilitate the understanding of phase transitions and phase equilibria in porous materials. In this work, adso...

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Detalles Bibliográficos
Autores principales: Li, Zhao, Turner, Jake, Snurr, Randall Q.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10167368/
https://www.ncbi.nlm.nih.gov/pubmed/37156883
http://dx.doi.org/10.1038/s42004-023-00889-3