title: Multicomponent NAPL source dissolution: evaluation of mass-transfer coefficients.
abstract: Mass transfer rate coefficients were quantified by employing an inverse modeling technique to high-resolution aqueous phase concentration data observed following an experimental release of a multicomponent nonaqueous phase liquid (NAPL) at a field site. A solute transport model (SEAM3D) was employed to simulate advective-dispersive transport over time coupled to NAPL dissolution. Model calibration was demonstrated by accurately reproducing the observed breakthrough times and peak concentrations at multiple observation points, observed mass discharge at pumping wells, and the reported mass depletions for three soluble NAPL constituents. Vertically variable NAPL mass transfer coefficients were derived for each constituent using an optimized numerical solute transport model, ranging from 0.082 to 2.0 day(-1) across all constituents. Constituent-specific coefficients showed a positive correlation with liquid-phase diffusion coefficients. Application of a time-varying mass transfer coefficient as NAPL mass depleted showed limited sensitivity during which over 80% of the most soluble NAPL constituent dissolved from the source. Long-term simulation results, calibrated to the experimental data and rendered in terms of mass discharge versus source mass depletion, exhibited multistage behavior.
authors.affiliation: The Charles E. Via, Jr. Department of Civil and Environmental Engineering, Virginia Tech, Blacksburg, Virginia 24061-0105, United States.
authors.forename: Michael A
authors.initials: MA
authors.lastname: Mobile
authors.forename: Mark A
authors.initials: MA
authors.lastname: Widdowson
authors.forename: Daniel L
authors.initials: DL
authors.lastname: Gallagher
mesh_terms: D003198:Computer Simulation; D004058:Diffusion; D060587:Groundwater / Q000737:chemistry*; D008956:Models, Chemical; D016062:Porosity; D012995:Solubility; D014872:Water Movements; D014873:Water Pollutants / Q000737:chemistry*
chemical_list: D014873:Water Pollutants