Relaxation of a steep density gradient in a simple fluid: Comparison between atomistic and continuum modeling

Combining Rare Events Techniques: Phase Change in Si Nanoparticles

(2011) Sergio Orlandini et al.   JOURNAL OF STATISTICAL PHYSICS

Temperature accelerated Monte Carlo (TAMC): a method for sampling the free energy surface of non-analytical collective variables

(2011) Giovanni Ciccotti et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Hydrodynamics from statistical mechanics: combined dynamical-NEMD and conditional sampling to relax an interface between two immiscible liquids

(2011) Sergio Orlandini et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

PLUMED: A portable plugin for free-energy calculations with molecular dynamics

(2009) Massimiliano Bonomi et al.   COMPUTER PHYSICS COMMUNICATIONS

Fast simulation of polymer chains

(2009) Carsten Hartmann et al.   JOURNAL OF CHEMICAL PHYSICS

Transient hydrodynamical behavior by dynamical nonequilibrium molecular dynamics: The formation of convective cells

(2009) M. L. Mugnai et al.   JOURNAL OF CHEMICAL PHYSICS