62 citations · 289 across the 20 of their papers we have counts for
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Monitoring the evolution of relative product populations at early times during a photochemical reaction
Joao Pedro Figueira Nunes, Lea Maria Ibele, Shashank Pathak +31
Identifying multiple rival reaction products and transient species formed during ultrafast photochemical reactions and determining their time-evolving relative populations are key…
A Theoretical Perspective on the Photochemistry of Boron-Nitrogen Lewis Adducts
Emanuele Marsili, Basile F. E. Curchod
Boron-Nitrogen (B-N) Lewis adducts form a versatile family of compounds with numerous applications in functional molecules. Despite the growing interest in this family of compounds…
On the description of conical intersections between excited electronic states with LR-TDDFT and ADC(2)
Jack T. Taylor, David J. Tozer, Basile F. E. Curchod
Conical intersections constitute the conceptual bedrock of our working understanding of ultrafast, nonadiabatic processes within photochemistry (and photophysics). Accurate calcula…
Deciphering the Influence of Ground-State Distributions on the Calculation of Photolysis Observables
Antonio Prlj, Daniel Hollas, Basile F. E. Curchod
Nonadiabatic molecular dynamics offers a powerful tool for studying the photochemistry of molecular systems. Key to any nonadiabatic molecular dynamics simulation is the definition…