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physics.chem-ph2026
Stochastic Cluster Expansion for Excited State Energies
Annabelle Canestraight, Russell Miller, Libor Veis +1
Excited-state electronic structure in strongly correlated systems remains challenging due to the exponential scaling of the many-body Hilbert space and the difficulty of constructi…
physics.chem-ph2023
Exceptional spatial variation of charge injection energies on plasmonic surfaces
Xiaohe Lei, Annabelle Canestraight, Vojtech Vlcek
Charge injection into a molecule on a metallic interface is a key step in many photo-activated reactions. The energy barrier for injection is paralleled with the lowest particle an…