2018 journal article
Coarse-grain modelling using an equation-of-state many-body potential: application to fluid mixtures at high temperature and high pressure
MOLECULAR PHYSICS, 116(21-22), 3271–3282.
2008 journal article
Molecular-level simulations of chemical reaction equilibrium for nitric oxide dimerization reaction in disordered nanoporous carbons
Fluid Phase Equilibria, 272(1-2), 18–31.
2008 journal article
Simulation of chemical reaction equilibria by the reaction ensemble Monte Carlo method: a review
Molecular Simulation, 34(2), 119–146.
2004 journal article
Reaction ensemble molecular dynamics: Direct simulation of the dynamic equilibrium properties of chemically reacting mixtures
Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics, 70(6).
2003 journal article
Formation of Spherical Micelles in a supercritical Solvent: Lattice Monte Carlo simulation and multicomponent solution model
Molecular Simulation, 29(2), 139–157.
2003 journal article
Thermal properties of supercritical carbon dioxide by Monte Carlo simulations
Molecular Simulation, 29(6-7), 405–412.
2002 journal article
Accurate CO2 Joule-Thomson inversion curve by molecular simulations
Fluid Phase Equilibria, 202(2), 253–262.
2002 journal article
Micellar behavior in supercritical solvent-surfactant systems from lattice Monte Carlo simulations
Fluid Phase Equilibria, 194(2002 Mar 30), 233–247.