Éric A. Perpète

Extensive TD-DFT Benchmark: Singlet-Excited States of Organic Molecules

Denis Jacquemin, Valérie Wathelet, Éric A. Perpète et al. · Journal of Chemical Theory and Computation · 2009 · 1.1K citations

Electronic Excited State, Excited State Property, Engineering +13

TD-DFT Performance for the Visible Absorption Spectra of Organic Dyes:  Conventional versus Long-Range Hybrids

Denis Jacquemin, Éric A. Perpète, Gustavo E. Scuseria et al. · Journal of Chemical Theory and Computation · 2007 · 859 citations

Engineering, Lr Functionals, Organic Dyes +23

Assessment of Conventional Density Functional Schemes for Computing the Dipole Moment and (Hyper)polarizabilities of Push−Pull π-Conjugated Systems

Benoı̂t Champagne, Éric A. Perpète, Denis Jacquemin et al. · The Journal of Physical Chemistry A · 2000 · 520 citations

Engineering, Dipole Moment, Computational Chemistry +17

Assessment of conventional density functional schemes for computing the polarizabilities and hyperpolarizabilities of conjugated oligomers: An <i>ab initio</i> investigation of polyacetylene chains

Benoı̂t Champagne, Éric A. Perpète, S. J. A. van Gisbergen et al. · The Journal of Chemical Physics · 1998 · 476 citations · Full text

Engineering, Computational Chemistry, Chemistry +16

Accurate Simulation of Optical Properties in Dyes

Denis Jacquemin, Éric A. Perpète, Ilaria Ciofini et al. · Accounts of Chemical Research · 2008 · 474 citations