52 citations · 58 across the 3 of their papers we have counts for
3 papers
physics.comp-ph2019★ 6 cited
Nuclear quantum effects in molecular dynamics simulations
H. Dammak, M. Hayoun, F Brieuc +1
To take into account nuclear quantum effects on the dynamics of atoms, the path integral molecular dynamics (PIMD) method used since 1980s is based on the formalism developed by R.…
cond-mat.stat-mech2016★ 52 cited
Zero-Point Energy Leakage in Quantum Thermal Bath Molecular Dynamics Simulations
Fabien Brieuc, Yael Bronstein, Hichem Dammak +3
The quantum thermal bath (QTB) has been presented as analternative to path-integral-based methods to introduce nuclear quantumeffects in molecular dynamics simulations. The method…
cond-mat.mtrl-sci2016
A rational use of BCA code MARLOWE for ballistic effects of ion beam irradiation in the ion mixing formalism: comparison to Molecular Dynamics
G. Demange, E. Antoshchenkova, M. Hayoun +2
Understanding ballistic effects caused by ion beam irradiation, and linking them with induced structure can be a key point for controlling and predicting the microstructure of irra…