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On the performance of hybrid functionals for nonlinear optical properties and electronic excitations in chiral molecular crystals: the case of butterfly-shaped dicinnamalacetone

Authors: Pedro Sidónio Pereira Silva, Pablo de Martín-Ramos, Sérgio R. Domingos, Maria do Carmo Bota Sousa, Cláudia T. Arranja, Abílio J.F.N. Sobral, Manuela Ramos Silva

Ref.: ChemPhysChem 19, 82-92 (2018)

DOI: 10.1002/cphc.201700975