This is a final configuration of a two-phase molecular dynamics simulation of Vapor-Liquid Equilibrium of Lennard-Jones Methane.

simulation parameters:
  • Temperature = 177 K
  • N = 8000 molecules
  • Equilibration Length = 5.15 ns
  • Simulation Length = 2 ns
  • Molecules colored by their phase:
    • green = liquid
    • blue = vapor
    • red = interfacial and molecules that are neither vapor or liquid
Vapor Liquid Equilibrium from Temperature Quench MD  


This is a final configuration of an MD simulation of VLE of Lennard Jones Methane

Simulation Parameters

  • Temperature = 177 K
  • N = 8000 molecules
  • Equilibration Length = 5.15 ns
  • Simulation Length = 2 ns
  • Molecules colored by their phase:
    • green = liquid
    • red = vapor
    • blue = interfacial molecules that are neither vapor or liquid