activity
20072023
most citedFull dimensional (15D) quantum-dynamical simulation of the protonated water-dimer II: infrared spectrum and vibrational dynamics

239 citations · 710 across the 11 of their papers we have counts for

collaborators

11 papers

physics.atom-ph2023

Charge transfer of polyatomic molecules in ion-atom hybrid traps: Stereodynamics in the millikelvin regime

Alexandre Voute, Alexander Dörfler, Laurent Wiesenfeld +4

Rate constants for the charge transfer reaction between NH and Rb in the mK regime are measured in an ion-atom hybrid trap and are found to be lower than the Langev…

physics.chem-ph2022

Stochastic Multi Configuration Time-Dependent Hartree for Dissipative Quantum Dynamics with Strong Intramolecular Coupling

Souvik Mandal, Fabien Gatti, Oussama Bindech +2

In this article, we explore the dissipation dynamics of a strongly coupled multidimensional system in contact with a Markovian bath following a system-bath approach. We use in this…

physics.chem-ph2022★ 7 cited

Intramolecular Vibrational Redistribution in Formic Acid and its Deuterated Forms

Antoine Aerts, Alex Brown, Fabien Gatti

The intramolecular vibrational relaxation dynamics of formic acid and its deuterated isotopologues is simulated on the full-dimensional potential energy surface of Richter and Carb…

physics.chem-ph2022

Laser control strategies in full dimensional funneling dynamics: The case of pyrazine

Samrit Mainali, Fabien Gatti, Osman Atabek

Motivated by the major role funneling dynamics plays in light-harvesting processes, we built some laser control strategies inspired from basic mechanisms such as interference and k…

physics.chem-ph2022★ 58 cited

The coupling of the hydrated proton to its first solvation shell

Markus Schröder, Fabien Gatti, David Lauvergnat +2

The transfer of a hydrated proton between water molecules in aqueous solution is accompanied by the large-scale structural reorganization of the environment as the proton relocates…

physics.atm-clus2016

Attosecond electronic and nuclear quantum photodynamics of ozone monitored with time and angle resolved photoelectron spectra

P. Decleva, N. Quadri, A. Perveaux +5

Recently we reported a series of numerical simulations proving that it is possible in principle to create an electronic wave packet and subsequent electronic motion in a neutral mo…