The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
Authors
Yan Zhao, Donald G. Truhlar
Journal
Theoretical Chemistry Accounts
Year Published
2007
Publisher
Springer Science+Business Media
Citations
30423 citations
Type
Article
Language
EN
Topics & Concepts
Abstract
The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals - Full text available via OpenAlex
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