A look at the density functional theory zoo with the advanced GMTKN55 database for general main group thermochemistry, kinetics and noncovalent interactions

Lars Goerigk, Andreas Hansen, Christoph Bauer, Stephan Ehrlich, Asim Najibi, Stefan Grimme
  • Physical Chemistry Chemical Physics, January 2017, Royal Society of Chemistry
  • DOI: 10.1039/c7cp04913g

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http://dx.doi.org/10.1039/c7cp04913g

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