Chemical and Biomolecular Engineering

Phase Equilibria Calculations with a Modified SAFT Equation of State. 1. Pure Alkanes, Alkanols, and Water

Industrial & Engineering Chemistry Research, 35(12), 4727–4737.

Molecular Simulations of Phase Transitions in Pores

Molecular Simulation, 17(4-6), 333–367.

Thermodynamic scaling Gibbs ensemble Monte Carlo: a new method for determination of phase coexistence properties of fluids

Molecular Physics, 89(4), 965–974.

Molecular Simulation of Fluid Phase Equilibria and Adsorption

Revue De l'Institut Français Du Pétrole, 51(1), 59–72.

Separation of carbon dioxide–methane mixtures by adsorption: Effects of geometry and energetics on selectivity

The Journal of Chemical Physics, 104(20), 8126–8134.

Theoretical Studies on VPI-5. 2. Energy Decomposition Analysis of the Hydrophilicity

The Journal of Physical Chemistry, 100(30), 12424–12430.

Molecular dynamics simulation of hydrogen bonding in monoethanolamine

Fluid Phase Equilibria, 116(1-2), 320–325.

Adsorption of Water on Activated Carbons:  A Molecular Simulation Study

The Journal of Physical Chemistry, 100(4), 1189–1196.

Molecular simulation of binary mixture adsorption in buckytubes and MCM-41

Adsorption, 2(1), 23–32.

The Effects of Salts on the Lower Consolute Boundary of a Nonionic Micellar Solution

Journal of Colloid and Interface Science, 184(2), 456–468.

Modeling of phase separation in PEG–salt aqueous two-phase systems

AIChE Journal, 42(12), 3508–3522.

First-Order Disorder-to-Order Transition in an Isolated Homopolymer Model

Physical Review Letters, 77(13), 2822–2825.

Equilibrium conformations and dynamic relaxation of double‐tethered chain molecules at an impenetrable interface

The Journal of Chemical Physics, 105(17), 7712–7722.

Binary hard chain mixtures. I. Generalized Flory equations of state

The Journal of Chemical Physics, 105(17), 7669–7682.

Estimation of mutual diffusion coefficients in polymer/penetrant systems using nonequilibrium molecular dynamics simulations

The Journal of Chemical Physics, 105(4), 1621–1632.

Corrections for analytical gas-permeation models for separation of binary gas mixtures using membrane modules

Journal of Membrane Science, 118(2), 289–294.

Computer simulation study of the approximations associated with the generalized Flory theories

The Journal of Chemical Physics, 104(22), 9100–9110.

Generalized Flory equations of state for hard heteronuclear chain molecules

The Journal of Chemical Physics, 104(13), 5220–5233.

Molecular dynamics study of entangled hard‐chain fluids

The Journal of Chemical Physics, 104(14), 5616–5637.

Propene Oxidation Chemistry in Laminar Premixed Flames

Bulletin Des Sociétés Chimiques Belges, 105(9), 501–512.