Gibbs

This plugin is in development and not ready for public use. Gibbs ensemble Monte Carlo simulations.

• CopyNextLine
• GibbsInitialize
• TrialGibbsParticleTransfer
• CopyFollowingLines
• ComputeGibbsParticleTransfer
• ComputeGibbsVolumeTransfer
• TrialGibbsVolumeTransfer
• CheckConstantVolume
• EndCopy

Tutorial

• Gibbs Ensemble Simulation of Lennard-Jones
• Gibbs Ensemble Simulation of TraPPE alkanes
• Gibbs Ensemble Simulation of SAFT-based MIE CO2 and N2

FEASST plugin dependencies

• monte_carlo