25 citations · 25 across the 1 of their papers we have counts for
2 papers
physics.chem-ph2022★ 25 cited
State-resolved infrared spectrum of the protonated water dimer: Revisiting the characteristic proton transfer doublet peak
Henrik R. Larsson, Markus Schröder, Richard Beckmann +4
The infrared (IR) spectra of protonated water clusters encode precise information on the dynamics and structure of the hydrated proton. However, the strong anharmonic coupling and…
physics.chem-ph2022
Infrared spectra at coupled cluster accuracy from neural network representations
Richard Beckmann, Fabien Brieuc, Christoph Schran +1
Infrared spectroscopy is key to elucidate molecular structures, monitor reactions and observe conformational changes, while providing information on both structural and dynamical p…