Evaluation of Modeling Approaches for Sorption–Desorption Processes in Flow-Through Soil Columns
Publication: Journal of Environmental Engineering
Volume 148, Issue 4
Abstract
The influence of soil organic matter and pore water velocity on the transport of naphthalene in flow-through columns was investigated. Pulse injection experiments were conducted using three different soils (with 0%, 1.9%, and 3.9% organic content by weight) and flow rates (0.05, 0.1, and ) and solvent extractions were performed to measure the nondesorbable naphthalene fraction. To describe interactions between contaminants in the aqueous and solid phases, observed breakthrough data were described using two-site models, four different formulations of a three-site model, and two fully kinetic models. While the two-site models did not adequately describe the breakthrough data for all cases, simulations based on the three-site models matched the observations well with the exception of high organic content soils and high flow rates. For soils with high organic content, the fully kinetic models described the observed data better compared to the three-site models. Results indicate that as long as the equilibrium, rate-limited, and irreversible sorption domains are included in the models, different conceptualizations about how contaminants interact in the aqueous and solid phases do not produce significantly different results.
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Data Availability Statement
Some or all data, models, or code generated or used during the study are available from the corresponding author by request (all data used in the study and model outputs).
References
Ahn, I. S., L. W. Lion, and M. L. Shuler. 1999. “Validation of a hybrid ‘two-site gamma’ model for naphthalene desorption kinetics.” Environ. Sci. Technol. 33 (18): 3241–3248. https://doi.org/10.1021/es971104l.
Aslam, I. 2006. “Modeling desorption kinetics in soil columns.” Ph.D. dissertation, Dept. of Civil and Environmental Engineering, Michigan State Univ.
Connaughton, D. F., J. R. Stedinger, L. W. Lion, and M. L. Schuler. 1993. “Description of time-varying desorption kinetics: Release of naphthalene from contaminated soils.” Environ. Sci. Technol. 27 (12): 2397–2403. https://doi.org/10.1021/es00048a013.
Cornelissen, G., P. C. M. Van Noort, and H. A. J. Govers. 1998. “Mechanism of slow desorption of organic compounds from sediments: A study using model sorbents.” Environ. Sci. Technol. 32 (20): 3124–3131. https://doi.org/10.1021/es970976k.
Cornelissen, G., P. C. M. Van Noort, J. R. Parsons, and H. A. J. Govers. 1997. “Temperature dependence of slow adsorption and desorption kinetics of organic compounds in sediments.” Environ. Sci. Technol. 31 (2): 454–460. https://doi.org/10.1021/es960300+.
Ding, D., D. A. Benson, D. Fernandez-Garcia, C. V. Henri, D. W. Hyndman, M. S. Phanikumar, and D. Bolster. 2017. “Elimination of the reaction rate ‘scale effect’: Application of the Lagrangian reactive particle-tracking method to simulate mixing-limited, field-Scale biodegradation at the Schoolcraft (MI, USA) site.” Water Resour. Res. 53 (12): 10411–10432. https://doi.org/10.1002/2017WR021103.
Højberg, A. L., and J. C. Refsgaard. 2005. “Model uncertainty-parameter uncertainty versus conceptual models.” Water Sci. Technol. 52 (6): 177–186.
Johnson, M., T. Keinath, and W. J. Weber. 2001. “A distributed reactivity model for sorption by soils and sediments. 14. Characterization and modeling of phenanthrene desorption rates.” Environ. Sci. Technol. 35 (8): 2734–2740. https://doi.org/10.1021/es001391k.
Kim, S.-B., H.-C. Ha, N.-C. Choi, and D.-J. Kim. 2006. “Influence of flow rate and organic carbon content on benzene transport in a sandy soil.” Hydrol. Process. 20 (20): 4307–4316. https://doi.org/10.1002/hyp.6164.
Maraqa, M. A. 1995. “Transport of dissolved volatile organic compounds in the unsaturated zone.” Ph.D. dissertation, Dept. of Civil and Environmental Engineering, Michigan State Univ.
Maraqa, M. A., X. Zhao, R. B. Wallace, and T. C. Voice. 1998. “Retardation coefficients of nonionic organic compounds determined by batch and column techniques.” Soil Sci. Soc. Am. J. 62 (1): 142–152. https://doi.org/10.2136/sssaj1998.03615995006200010019x.
Nkedi-kizza, P., J. W. Biggar, M. T. Vangenuchten, P. J. Wierenga, H. M. Selim, J. M. Davidson, and D. R. Nielsen. 1983. “Modeling tritium and chloride-36 transport through an aggregated oxisol.” Water Resour. Res. 19 (3): 691–700.
Park, J. H. 2000. “Bioavailability of sorbed organic contaminants.” Ph.D. dissertation, Dept. of Civil and Environmental Engineering, Michigan State Univ.
Park, J. H., Y. C. Feng, S. Y. Cho, T. C. Voice, and S. A. Boyd. 2004. “Sorbed atrazine shifts into non-desorbable sites of soil organic matter during aging.” Water Res. 38 (18): 3881–3892. https://doi.org/10.1016/j.watres.2004.06.026.
Park, J. H., Y. C. Feng, P. S. Ji, T. C. Voice, and S. A. Boyd. 2003a. “Assessment of bioavailability of soil-sorbed atrazine.” Appl. Environ. Microbiol. 69 (6): 3288–3298. https://doi.org/10.1128/AEM.69.6.3288-3298.2003.
Park, J. H., Y. C. Feng, T. C. Voice, and S. A. Boyd. 2003b. “Aging effect on mechanism-specific sorption and desorption of atrazine.” In Vol. 226 of Abstracts of papers of the American chemical society, U515. New York: American Chemical Society.
Park, J. H., X. D. Zhao, and T. C. Voice. 2001. “Biodegradation of non-desorbable naphthalene in soils.” Environ. Sci. Technol. 35 (13): 2734–2740. https://doi.org/10.1021/es0019326.
Park, J. H., X. D. Zhao, and T. C. Voice. 2002. “Development of a kinetic basis for bioavailability of sorbed naphthalene in soil slurries.” Water Res. 36 (6): 1620–1628. https://doi.org/10.1016/S0043-1354(01)00360-8.
Phanikumar, M. S., and D. W. Hyndman. 2003. “Interactions between sorption and biodegradation: Exploring bioavailability and pulsed nutrient injection efficiency.” Water Resour. Res. 39 (5): 1–13. https://doi.org/10.1029/2002WR001761.
Phanikumar, M. S., D. W. Hyndman, D. C. Wiggert, M. J. Dybas, M. E. Witt, and C. S. Criddle. 2002. “Simulation of microbial transport and carbon tetrachloride biodegradation in intermittently-fed aquifer columns.” Water Resour. Res. 38 (4): 1–13. https://doi.org/10.1029/2001WR000289.
Phanikumar, M. S., D. W. Hyndman, X. Zhao, and M. J. Dybas. 2005. “A three-dimensional model of microbial transport and bioremediation at the Schoolcraft, Michigan site.” Water Resour. Res. 41 (5): W05011. https://doi.org/10.1029/2004WR003376.
Pignatello, J. J. 1990. “Slowly reversible sorption of aliphatic halocarbons in soils. 1. Formation of residual fractions.” Environ. Toxicol. Chem. 9 (9): 1107–1115. https://doi.org/10.1002/etc.5620090901.
Prata, F., A. Lavorenti, V. Jan, P. Burauel, and H. Vereecken. 2003. “Miscible displacement, sorption and desorption of atrazine in a Brazilian oxisol.” Vadose Zone J. 2: 728–738.
Rao, P. S. C., J. M. Davidson, R. E. Jessup, and H. M. Selim. 1979. “Evaluation of conceptual models for describing nonequilibrium adsorption-desorption of pesticides during steady flow in soils.” Soil Sci. Soc. Am. J. 43 (1): 22–28. https://doi.org/10.2136/sssaj1979.03615995004300010004x.
Saffron, C. M., J.-H. Park, B. E. Dale, and T. C. Voice. 2006. “Kinetics of contaminant desorption from soil: Comparison of model formulations using the Akaike information criterion.” Environ. Sci. Technol. 40 (24): 7662–7667. https://doi.org/10.1021/es0603610.
Satkowski, L. E., K. W. Goyne, S. H. Anderson, R. N. Lerch, E. B. Webb, and D. D. Snow. 2018. “Imidacloprid sorption and transport in cropland, grass buffer, and riparian buffer soils.” Vadose Zone J. 17 (170139): 1–12. https://doi.org/10.2136/vzj2017.07.0139.
Seyfried, M. S., and P. S. C. Rao. 1987. “Solute transport in undisturbed columns of an aggregated tropical soil—Preferential flow effects.” Soil Sci. Soc. Am. J. 51 (6): 1434–1444. https://doi.org/10.2136/sssaj1987.03615995005100060008x.
Sharer, M., J. H. Park, T. C. Voice, and S. A. Boyd. 2003a. “Aging effects on the sorption-desorption characteristics of anthropogenic organic compounds in soil.” J. Environ. Qual. 32 (4): 1385–1392. https://doi.org/10.2134/jeq2003.1385.
Sharer, M., J. H. Park, T. C. Voice, and S. A. Boyd. 2003b. “Time dependence of chlorobenzene sorption/desorption by soils.” Soil Sci. Soc. Am. J. 67 (6): 1740–1745. https://doi.org/10.2136/sssaj2003.1740.
Shi, B., S. K. Ngueleu, F. Rezanezhad, S. Slowinski, G. J. Pronk, C. M. Smeaton, K. Stevenson, R. I. Al-Raoush, and P. Van Cappellen. 2020. “Sorption and desorption of the model aromatic hydrocarbons naphthalene and benzene: Effects of temperature and soil composition.” Front. Environ. Chem. 1–11. https://doi.org/10.3389/fenvc.2020.581103.
Toride, N., F. J. Leij, and M. T. Van Genuchten. 1999. The CXTFIT code for estimating transport parameters from laboratory or field tracer experiments. Riverside, CA: US Salinity Laboratory.
Van Genuchten, M. T., and R. J. Wagenet. 1989. “Two-site/two-region models for pesticide transport and degradation: Theoretical development and analytical solutions.” Soil Sci. Soc. Am. J. 53 (5): 1303–1310. https://doi.org/10.2136/sssaj1989.03615995005300050001x.
Van Genuchten, M. T., and P. J. Wierenga. 1977. “Mass transfer studies in sorbing porous media. 2. Experimental evaluation with tritium ().” Soil Sci. Soc. Am. J. 41 (2): 272–278.
Wehrhan A., R. Kasteel, J. Simunek, J. Groeneweg, H. Vereecken. 2008. “Transport of sulfadiazine in soil columns—Experiments and modelling approaches.” J. Contam. Hydrol. 89 (1–2): 107–135. https://doi.org/10.1016/j.jconhyd.2006.08.002.
Yang, L., J. P. Hnatko, J. L. Elsey, J. A. Christ, K. D. Pennell, N. L. Cápiro, and L. M. Abriola. 2021. “Exploration of processes governing microbial reductive dechlorination in a heterogeneous aquifer flow cell.” Water Res. 193 (Apr): 116842. https://doi.org/10.1016/j.watres.2021.116842.
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Published In
Journal of Environmental Engineering
Volume 148 • Issue 4 • April 2022
Copyright
© 2022 American Society of Civil Engineers.
History
Received: Apr 8, 2021
Accepted: Nov 11, 2021
Published online: Jan 27, 2022
Published in print: Apr 1, 2022
Discussion open until: Jun 27, 2022
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