Beyond Energies: Geometries of Nonbonded Molecular Complexes as Metrics for Assessing Electronic Structure Approaches

Jonathon Witte, Matthew Goldey, Jeffrey B. Neaton, Martin Head-Gordon

Research output: Contribution to journalArticlepeer-review

36 Scopus citations
Original languageEnglish (US)
Pages (from-to)1481-1492
Number of pages12
JournalJournal of Chemical Theory and Computation
Volume11
Issue number4
DOIs
StatePublished - 2015

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