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Elisa Liberatore
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Charge migration and charge transfer in molecular systems
HJ Wörner, CA Arrell, N Banerji, A Cannizzo, M Chergui, AK Das, ...
Structural dynamics 4 (6), 2017
1882017
Photoemission and photoionization time delays and rates
UK L. Gallmann, I. Jordan, H. J. Wörner, L. Castiglioni, M. Hengsberger, J ...
Structural Dynamics 4, 061502, 2017
51*2017
Nonadiabatic effects in electronic and nuclear dynamics
UR Martin P. Bircher, Elisa Liberatore, Nicholas J. Browning, Sebastian ...
Structural Dynamics, 061510, 2017
472017
Molecular-atomic transition along the deuterium Hugoniot curve with coupled electron-ion Monte Carlo simulations
NM Tubman, E Liberatore, C Pierleoni, M Holzmann, DM Ceperley
Physical review letters 115 (4), 045301, 2015
422015
In situ parameterisation of SCC-DFTB repulsive potentials by iterative Boltzmann inversion
M Doemer, E Liberatore, JM Knaup, I Tavernelli, U Rothlisberger
Molecular Physics 111 (22-23), 3595-3607, 2013
392013
A Versatile Multiple Time Step Scheme for Efficient ab Initio Molecular Dynamics Simulations
E Liberatore, R Meli, U Rothlisberger
Journal of chemical theory and computation 14 (6), 2834-2842, 2018
312018
Ultrafast Relaxation Dynamics of the Ethylene Cation C2H4+
A Ludwig, E Liberatore, J Herrmann, L Kasmi, P López-Tarifa, L Gallmann, ...
The journal of physical chemistry letters 7 (10), 1901-1906, 2016
282016
Free energy methods in coupled electron ion Monte Carlo
E Liberatore, MA Morales, DM Ceperley, C Pierleoni
Molecular Physics 109 (23-24), 3029-3036, 2011
262011
Liquid-solid transition in fully ionized hydrogen at ultra-high pressures
E Liberatore, C Pierleoni, DM Ceperley
The Journal of chemical physics 134 (18), 2011
202011
A theoretical perspective of the ultrafast transient absorption dynamics of CsPbBr3
A Boziki, P Baudin, E Liberatore, N Ashari Astani, U Rothlisberger
Journal of Computational Chemistry, 2022
22022
New Insights into Ultrafast Relaxation Dynamics of the Ethylene Cation C2H4+
M Lucchini, A Ludwig, E Liberatore, J Herrmann, L Kasmi, L Gallmann, ...
International Conference on Ultrafast Phenomena, UTu1A. 3, 2016
2016
Ultrafast relaxation dynamics of the ethylene ionized by XUV attosecond pulses
M Lucchini, A Ludwig, E Liberatore, J Herrmann, L Kasmi, L Gallmann, ...
39th International Conference on Vacuum Ultraviolet and X-ray Physics (VUVX …, 2016
2016
Molecular-Atomic Transition in the Deuterium Hugoniot with Coupled Electron Ion Monte Carlo
NM Tubman, E Liberatore, C Pierleoni, M Holzmann, DM Ceperley
arXiv preprint arXiv:1408.6523, 2014
2014
LCBC
A Antalik, B Araujo Cautiero Horta, JS Arey, N Ashari Astani, PJ Baudin, ...
Ultrafast Relaxation Dynamics of the Ethylene Cation C
A Ludwig, E Liberatore, J Herrmann, L Kasmi, P López-Tarifa, L Gallmann, ...
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