View Image: NPT Molecular dynamics simulation of a Lennard-Jones monomer system
Citation:
Iacovella, Christopher R. (2006). NPT Molecular dynamics simulation of a Lennard-Jones monomer system. Glotzer group. Depts of Chemical Engineering, Materials Science & Engineering, Macromolecular Science, and Physics,University of Michigan.
Number of particles = 1000 ; System temperature as a function of time = 0.5; System pressure as a func of time = 10.0 ; Integration scheme to use = Molecular Dynamics, Martyna
barostat, NPT; Timestep for integration of eqns of motion = 0.005; Number of Dimensions = 3 ;