Benchmarking density functional theory predictions of framework structures and properties in a chemically diverse test set of metal–organic frameworks

Dalar Nazarian, P. Ganesh, David S. Sholl

Research output: Contribution to journalArticlepeer-review

36 Scopus citations
Original languageEnglish (US)
Pages (from-to)22432-22440
Number of pages9
JournalJournal of Materials Chemistry A
Volume3
Issue number44
DOIs
StatePublished - 2015

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