Retrofitting metal-organic frameworks

Autor: Christian Schneider, David Bodesheim, Julian Keupp, Rochus Schmid, Gregor Kieslich
Jazyk: angličtina
Rok vydání: 2019
Předmět:
Zdroj: Nature Communications, Vol 10, Iss 1, Pp 1-10 (2019)
Druh dokumentu: article
ISSN: 2041-1723
DOI: 10.1038/s41467-019-12876-1
Popis: Retrofitting is recognized as a powerful tool to control the structure and the corresponding functionality in MOFs. Here, the authors develop a low-cost computational framework to guide experimentalists for retrofitting experiments in MOFs and test it on the prototypical Cu3BTC2 MOF.
Databáze: Directory of Open Access Journals