Publications and responsibilities
Modelling and Simulation of Metal-Air Batteries
Oxidation of Liquid Silicon in Air Atmospheres Containing Water Vapor
Towards rigorous multiscale flow models of nanoparticle reactivity in chemical looping applications
A multiscale modeling framework is described and applied to the reactivity of iron oxide nanoparticles in a chemical looping reforming (CLR) reactor. At the atomic scale/nanoscale, we have performed kinetic Monte Carlo modeling, guided by Density Functional Theory calculations, on the detailed...