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Porous subset of QMOF

Open Andrew-S-Rosen opened this issue 3 years ago • 1 comments

I like how the QMOF dataset has a variety of subsets. I think a useful one to add for the MOF community would be a subset that is porous (or nearly porous). The dataset intentionally is a combination of coordination polymers and MOFs. Perhaps we could have a subset that has PLD > 2.7 A as done by default with CoRE MOF? That's not porous to N2 of course, but it would be a consistent convention.

Thoughts?

Andrew-S-Rosen avatar Aug 06 '22 06:08 Andrew-S-Rosen

good idea!

kjappelbaum avatar Aug 06 '22 08:08 kjappelbaum