160 citations · 1.1k across the 30 of their papers we have counts for
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physics.comp-ph2017★ 12 cited
Transient hydrodynamic finite size effects in simulations under periodic boundary conditions
Adelchi J. Asta, Maximilien Levesque, Rodolphe Vuilleumier +1
We use Lattice-Boltzmann and analytical calculations to investigate transient hydrodynamic finite size effects induced by the use of periodic boundary conditions in simulations at…
physics.chem-ph2017
Fully quantum description of the Zundel ion: combining variational quantum Monte Carlo with path integral Langevin dynamics
Félix Mouhat, Sandro Sorella, Rodolphe Vuilleumier +2
We introduce a novel approach for a fully quantum description of coupled electron-ion systems from first principles. It combines the variational quantum Monte Carlo (QMC) solution…