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Validation of density functionals for pancake-bonded π-dimers; dispersion is not enough

Zhongyu Mou1, Yong-Hui Tian, Miklos Kertesz

  • 1Department of Chemistry and the Institute of Soft Matter Synthesis and Metrology, Georgetown University, 37th & O Streets, NW, Washington, DC 20057-1227, USA. Kertesz@georgetown.edu.

Physical Chemistry Chemical Physics : PCCP
|September 5, 2017
PubMed

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