Applications and validations of the Minnesota density functionals

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Abstract

We discuss and review selected recent applications and validations of the Minnesota density functionals, especially the M06 family, emphasizing nanochemistry, organic, inorganic, and biological chemistry, and catalysis and highlighting the broad accuracy of these functionals as compared to previous popular functionals for thermochemistry, kinetics, and noncovalent interactions.

Original languageEnglish (US)
Pages (from-to)1-13
Number of pages13
JournalChemical Physics Letters
Volume502
Issue number1-3
DOIs
StatePublished - Jan 18 2011

Bibliographical note

Funding Information:
This work was supported in part by the National Science Foundation and by the Air Force Office of Scientific Research .

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