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The Journal of Chemical Physics|June 11, 2005
Molecular sieve valves driven by adsorbate-adsorbate interactions: hysteresis in permeation of microporous membranesM A Snyder, D G VlachosPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|August 11, 2005
Molecular valves actuated by intermolecular forcesM A Snyder, D G VlachosThe Journal of Chemical Physics|November 19, 2005
The role of molecular interactions and interfaces in diffusion: transport diffusivity and evaluation of the Darken approximationM A Snyder, D G VlachosThe Journal of Chemical Physics|November 19, 2005
The role of molecular interactions and interfaces in diffusion: permeation through single-crystal and polycrystalline microporous membranesM A Snyder, D G VlachosPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|November 13, 2008
Temporal coarse-graining of microscopic-lattice kinetic Monte Carlo simulations via tau leapingD G VlachosThe Journal of Physical Chemistry. B|December 13, 2007
Molecular dynamics study of the stabilization of the silica hexamer Si6O15(6-) in aqueous and methanolic solutionsS Caratzoulas, D G VlachosThe Journal of Chemical Physics|October 22, 2005
Overcoming stiffness in stochastic simulation stemming from partial equilibrium: a multiscale Monte Carlo algorithmA Samant, D G VlachosThe Journal of Chemical Physics|February 2, 2015
Steady state likelihood ratio sensitivity analysis for stiff kinetic Monte Carlo simulationsM Núñez, D G VlachosThe Journal of Physical Chemistry. B|July 21, 2006
Hierarchical multiscale mechanism development for methane partial oxidation and reforming and for thermal decomposition of oxygenates on RhA B Mhadeshwar, D G VlachosJournal of the American Chemical Society|December 15, 2006
Potential of mean force for tetramethylammonium binding to cagelike oligosilicates in aqueous solutionS Caratzoulas, D G Vlachos, M TsapatsisPageof 4