144 citations · 207 across the 5 of their papers we have counts for
5 papers
Structure of the glass-forming metallic liquids by ab-initio and classical molecular dynamics, a case study: quenching the Cu60Ti20Zr20 alloy
S. Amokrane, A. Ayadim, L. Levrel
We consider the question of the amorphization of metallic alloys by melt quenching, as predicted by molecular dynamics simulations with semi-empirical potentials. The parametrizati…
Boundary conditions in local electrostatics algorithms
L. Levrel, A. C. Maggs
We study the simulation of charged systems in the presence of general boundary conditions in a local Monte Carlo algorithm based on a constrained electric field. We firstly show ho…
Monte Carlo algorithms for charged lattice gases
L. Levrel, A. C. Maggs
We consider Monte Carlo algorithms for the simulation of charged lattice gases with purely local dynamics. We study the mobility of particles as a function of temperature and show…
Local Simulation Algorithms for Coulombic Interactions
L. Levrel, F. Alet, J. Rottler +1
We consider dynamically constrained Monte-Carlo dynamics and show that this leads to the generation of long ranged effective interactions. This allows us to construct a local algor…
Local Simulation Algorithms for Coulomb Interaction
A. C. Maggs, V. Rossetto
Long ranged electrostatic interactions are time consuming to calculate in molecular dynamics and Monte-Carlo simulations. We introduce an algorithmic framework for simulating charg…