A series of miscible displacement tests were performed on a 51 mm wide by 76 mm long well-laminated core of Berea Sandstone to determine the transport parameters of the anion bromide and a homologous series of seventeen mononuclear aromatic hydrocarbons (MAHs). In each test, a continuous input pulse of a single tracer was passed through the cylindrical core housed in a hydrostatic core holder at a confining pressure of 200 bar. The effluent concentration, as measured by in-line UV absorbance, versus time resulted in smooth high-resolution sinusoidal breakthrough curves (BTCs). In comparison to the near Gaussian BTCs of bromide, the transport of the MAHs was differentially retarded with minimal levels of delayed transport along the more rapid flow lines, but with progressively more along the slower flow paths. These results show that despite a lack of significant hydraulic heterogeneity, there is a high degree of heterogeneity among the sorption sites. The BTCs were aptly modeled with a one-dimensional flow model consisting of a mixture of instantaneous equilibrium and rate-limited reversible sorption sites. The relative fraction of instantaneous sites increased proportionately with the rate the subject MAH passed through the core. Potential quantitative structure-retention relationships (QSRR) between common chemical parameters of the MAHs and their overall retardation factors, sorption coefficients and the fraction of instantaneous equilibrium were evaluated. Among the compounds examined, relatively strong correlations were found with molecular weight, aqueous solubility, and octanol-water partitioning coefficient with which relative MAH transport retardation, the linear phase distribution coefficient, and the dimensionless partitioning coefficient between sorption sites.
Keywords: Benzene; Berea; Bromide; Contaminant transport; Groundwater; Hydraulic fracturing; QSAR; Sandstone; Toluene; Xylene.
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