Expanded grand canonical and Gibbs ensemble Monte Carlo simulation of polymers

Computer Simulation of Liquids

2017 • 20,627 citations

Some Topics in the Theory of Fluids

1963 • 2,856 citations

Direct determination of phase coexistence properties of fluids by Monte Carlo simulation in a new ensemble

2002 • 1,664 citations

Phase equilibria by simulation in the Gibbs ensemble

1988 • 1,135 citations

New approach to Monte Carlo calculation of the free energy: Method of expanded ensembles

1992 • 1,011 citations

Novel scheme to study structural and thermal properties of continuously deformable molecules

1992 • 455 citations

Determination of the chemical potentials of polymeric systems from Monte Carlo simulations

1991 • 172 citations

Vapour liquid equilibrium of a pure fluid from test particle method in combination with NpT molecular dynamics simulations

1990 • 146 citations

Extended continuum configurational bias Monte Carlo methods for simulation of flexible molecules

1995 • 132 citations

Monte Carlo simulation of the chemical potential of polymers in an expanded ensemble

1995 • 108 citations

Accurate measurements of the chemical potential of polymeric systems by Monte Carlo simulation

1994 • 93 citations

Simulation and prediction of vapour-liquid equilibria for chain molecules

1996 • 91 citations

Simulation of the chemical potential and the cavity free energy of dense hard-sphere fluids

1993 • 87 citations

Computer simulation of the chemical potentials of binary hard-sphere mixtures

1996 • 66 citations

A conductivity technique for gas and solids holdup determination in three-phase reactors

1994 • 59 citations

Monte Carlo simulation of the equilibrium partitioning of chain fluids between a bulk and a pore

1991 • 59 citations

Chemical potential and equations of state of hard core chain molecules

1995 • 50 citations

Umbrella-sampling realization of ‘‘Widom’’ chemical potential estimation

1993 • 46 citations

Molecular simulation in a pseudo grand canonical ensemble

1995 • 37 citations

Monte Carlo evaluation of ensemble averages involving particle number variations in dense fluid systems

1994 • 32 citations

Chemical potentials and adsorption isotherms of polymers confined between parallel plates

1994 • 18 citations