88 citations · 587 across the 37 of their papers we have counts for
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Robust Tensor Hypercontraction of the Particle-Particle Ladder Term in Equation-of-Motion Coupled Cluster Theory
Avdhoot Datar, Devin A. Matthews
One method of representing a high-rank tensor as a (hyper-)product of lower-rank tensors is the tensor hypercontraction (THC) method of Hohenstein et al. This strategy has been fou…
Open-shell Tensor Hypercontraction
Tingting Zhao, Megan Simons, Devin A. Matthews
The extension of least-squares tensor hypercontracted second- and third-order Møller-Plessett perturbation theory (LS-THC-MP2 and LS-THC-MP3) to open-shell systems is an important…
Transition moments for STEOM-CCSD with core triples
Megan Simons, Devin A. Matthews
Similarity transformed equation-of-motion coupled cluster theory (STEOM-CC) is an alternative approach to equation-of-motion coupled cluster theory for excited states (EOMEE-CC) wh…
Ab Initio Investigation of Intramolecular Charge Transfer States in DMABN by Calculation of Excited State X-ray Absorption Spectra
Avdhoot Datar, Saisrinivas Gudivada, Devin A. Matthews
Dual fluorescence in 4-(dimethylamino)benzonitrile (DMABN) and its derivatives in polar solvents has been studied extensively for the past several decades. An intramolecular charge…