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Effect of Metal–Organic Framework (MOF) Database Selection on the Assessment of Gas Storage and Separation Potentials of MOFs

Development of computation‐ready metal–organic framework databases (MOF DBs) has accelerated high‐throughput computational screening (HTCS) of materials to identify the best candidates for gas storage and separation. These DBs were constructed using structural curations to make MOFs directly usable...

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Detalhes bibliográficos
Publicado no:Angew Chem Int Ed Engl
Main Authors: Daglar, Hilal, Gulbalkan, Hasan Can, Avci, Gokay, Aksu, Gokhan Onder, Altundal, Omer Faruk, Altintas, Cigdem, Erucar, Ilknur, Keskin, Seda
Formato: Artigo
Idioma:Inglês
Publicado em: John Wiley and Sons Inc. 2021
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC8049020/
https://ncbi.nlm.nih.gov/pubmed/33443312
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/anie.202015250
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