September 1, 2012
Journal Article

Molecular interactions of SO2 with carbonate minerals under co-sequestration conditions: a combined experimental and theoretical study

Abstract

We present a combined experimental and theoretical study investigating the reactivity between selected and morphologically important surfaces of carbonate minerals with supercritical CO2 with co-existing H2O and SO2. Trace amounts of SO2 cause formation of CaSO3 in the form of hannebachite in the initial stages of SO2 adsorption and transformation. Atomistic simulations of these initial steps indicate a somewhat catalytic activity of water, which is enhanced by the presence of Magnesium atoms in the mineral surface. Under co-sequestration conditions, traces of water are not likely to cause carbonate dissolution, however the presence of SO2 greatly stabilizes the sulfite product. Pacific Northwest National Laboratory is operated by Battelle for the US Department of Energy.

Revised: August 20, 2012 | Published: September 1, 2012

Citation

Glezakou V.A., B.P. McGrail, and H.T. Schaef. 2012. Molecular interactions of SO2 with carbonate minerals under co-sequestration conditions: a combined experimental and theoretical study. Geochimica et Cosmochimica Acta 92. PNNL-SA-83215. doi:10.1016/j.gca.2012.06.015