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The diene isomerization energies dataset: A difficult test for double-hybrid density functionals?

M Wykes1, A J Pérez-Jiménez2, C Adamo3

  • 1Madrid Institute for Advanced Studies, IMDEA Nanoscience, Calle Faraday 9, Campus Cantoblanco, E-28049 Madrid, Spain.

The Journal of Chemical Physics
|June 15, 2015
PubMed

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