@article { ISI:000390625800009,
	title = {Effects of Knudsen diffusivity on the effective reactivity Of nanoporous catalyst media},
	journal = {JOURNAL OF COMPUTATIONAL SCIENCE},
	volume = {17},
	number = {2, SI},
	year = {2016},
	note = {24th International Conference on Discrete Simulation of Fluid Dynamics (DSFD), Royal Soc Edinburgh, Edinburgh, SCOTLAND, JUL 13-17, 2015},
	month = {NOV},
	pages = {377-383},
	abstract = {We investigate the non-equilibrium hydrodynamic effects on the reactivity of a nanoporous catalytic sample. Numerical simulations using the Lattice Boltzmann Method (LBM) show that non-equilibrium effects enhance the reactivity of the porous sample, in agreement with theoretical predictions [1]. In addition, we provide a quantitative assessment of the reactivity in terms of the thickness of the reactive layer inside the nanoporous catalytic sample. Such an assessment constitutes a first step towards integrated simulations encompassing nanoscale reactivity and transport coefficients within a macroscale description of experimental relevance. (C) 2016 Elsevier B.V. All rights reserved.},
	issn = {1877-7503},
	doi = {10.1016/j.jocs.2016.04.006},
	author = {Montessori, A. and Prestininzi, P. and La Rocca, M. and Falcucci, G. and S. Succi and E. Kaxiras}
}
