Articles with "prediction hetero" as a keyword



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Computational prediction of hetero-interpenetration in metal-organic frameworks.

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Published in 2017 at "Chemical communications"

DOI: 10.1039/c6cc08940b

Abstract: We present a computational algorithm that can screen through a database of metal-organic framework structures and identify materials that lead to hetero-interpenetration with targeted porous materials. Two MOFs (IRMOF-1 and IRMOF-8) were selected as target… read more here.

Keywords: computational prediction; hetero interpenetration; metal organic; prediction hetero ... See more keywords