Assessing challenging intra- and inter-molecular charge-transfer excitations energies with double-hybrid density functionals

von Brémond, Éric
Veröffentlicht in: Journal of computational chemistry (2021)

Determining the role of the underlying orbital-dependence of PBE0-DH and PBE-QIDH double-hybrid density functionals

von Sancho-García, Juan Carlos
Veröffentlicht in: Journal of computational chemistry (2017)