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

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Éric Brémond, Alistar Ottochian, Ángel J. Pérez-Jiménez, Ilaria Ciofini, Giovanni Scalmani, Michael J. Frisch, Juan Carlos Sancho-García, Carlo Adamo. Assessing challenging intra- and inter-molecular charge-transfer excitations energies with double-hybrid density functionals. Journal of Computational Chemistry, 42(14):970-981, 2021. [doi]

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