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Nonadiabatic vibrational dynamics of CO on Pt(111) studied with first-principles many-body perturbation theory
Raúl Bombín, Iñaki Fernández Tena, J. Iñaki Juaristi +1
We investigate the nonequilibrium vibrational dynamics of CO adsorbed on Pt(111), a prototypical adsorbate-surface system for ultrafast vibrational spectroscopy, using a first-prin…
Vibrational dynamics of CO on Pd(111) in and out of thermal equilibrium
Raúl Bombín, Alberto S. Muzas, Dino Novko +2
Using many-body perturbation theory and density functional perturbation theory, we study the vibrational spectra of the internal stretch (IS) mode of CO on Pd(111) for the bridge a…
Anomalous transient blueshift in the internal stretch mode of CO/Pd(111)
Raúl Bombín, Alberto S. Muzas, Dino Novko +2
In time-resolved pump-probe vibrational spectroscopy the internal stretch mode of polar molecules is utilized as a key observable to characterize the ultrafast dynamics of adsorbat…