Assessing DFT-D3 Damping Functions Across Widely Used Density Functionals: Can We Do Better?

Jonathon Witte, Narbe Mardirossian, Jeffrey B. Neaton, Martin Head-Gordon

Research output: Contribution to journalArticlepeer-review

34 Scopus citations
Original languageEnglish (US)
Pages (from-to)2043-2052
Number of pages10
JournalJournal of Chemical Theory and Computation
Volume13
Issue number5
DOIs
StatePublished - 2017

Cite this