Interactions of corrosion products and bentonite: An extended multicomponent reactive transport model

Physics and Chemistry of the Earth

Volumn 36, Issue 17-18, 2011, Pages 1661-1668

  Lu, Chuanhe ^a,c   Samper, Javier ^a   Fritz, Bertrand ^b   Clement, Alain ^b   Montenegro, Luis ^a  

^a UNIVERSITY OF A CORUÑA   (Spain)

^b UNIVERSITÉ DE STRASBOURG   (France)

^c LAWRENCE LIVERMORE NATIONAL LABORATORY   (United States)

Author keywords

Bentonite; Canister corrosion; Carbon steel; Granite; Numerical model; Reactive transport

Indexed keywords

CHEMICAL EVOLUTION; CHEMICAL INTERACTIONS; COMPACTED BENTONITE; COMPETITION EFFECTS; CORROSION PRODUCTS; DEEP GEOLOGICAL REPOSITORY; DISTRIBUTION COEFFICIENT; ENGINEERED BARRIERS; IRON CONCENTRATIONS; KEY REACTIONS; LOCAL EQUILIBRIUM; LONG TERM PERFORMANCE; MULTICOMPONENTS; NEAR FIELDS; NUMERICAL MODELS; PORE WATERS; REACTIVE TRANSPORT; REACTIVE TRANSPORT MODELS; SORPTION SITES; SURFACE COMPLEXATION; TIME EVOLUTIONS;

COMPLEXATION; CONCENTRATION (PROCESS); CORROSION RATE; DISSOLUTION; GEOLOGICAL REPOSITORIES; GRANITE; KINETICS; MAGNETITE; MODELS; NUMERICAL METHODS; RADIOACTIVE WASTE DISPOSAL; RADIOACTIVE WASTE TRANSPORTATION; RADIOACTIVE WASTES; SORPTION; SURFACE REACTIONS; WASTE DISPOSAL;

BENTONITE;

BENTONITE; CONCENTRATION (COMPOSITION); CORROSION; GRANITE; NUMERICAL MODEL; PH; POREWATER; RADIOACTIVE WASTE; REACTION KINETICS; REACTIVE TRANSPORT; REPOSITORY; STRUCTURAL GEOLOGY; WASTE DISPOSAL;

EID: 82955162474     PISSN: 14747065     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.pce.2011.07.013     Document Type: Article

References (34)

1. Bildstein O., Trotignon L., Perronnet M., Jullien M. Modelling iron-clay interactions in deep geological disposal conditions. Physics and Chemistry of the Earth 2006, 31:618-625.
2. Bradbury M.H., Baeyens B. A mechanistic description of Ni and Zn sorption on Na-montmorillonite. Part II: Modelling. Journal of Contaminant Hydrology 1997, 27:223-248.
3. Bradbury M.H., Baeyens B. Porewater chemistry in compacted re-saturated MX-80 bentonite. Journal of Contaminant Hydrology 2003, 61:329-338.
4. Bradbury M.H., Baeyens B. Modelling the sorption of Mn(II), Co(II), Ni(II), Zn(II), Cd(II), Eu(III), Am(III), Sn(IV), Th(IV), Np(V) and U(VI) on montmorillonite: Linear free energy relationships and estimates of surface binding constants for some selected heavy metals and actinides. Geochimica et Cosmochimica Acta 2005, 69(4):829-875.
5. Carlson L., Karnland O., Oversby V.M., Rance A.P., Smart N.R., Snellman M., Vähänen M., Werme L.O. Experimental studies of the interactions between anaerobically corroding iron and bentonite. Physics and Chemistry of the Earth 2007, 32:334-345.
6. Combarieu G., Barboux P., Minet Y. Iron corrosion in Callovo-Oxfordian argilite: From experiments to thermodynamic/kinetic modelling. Physics and Chemistry of the Earth 2007, 32:346-358.
7. ENRESA, 2005. NF-PRO Project. Phenomenological description. Reference Concept (Spent Fuel-Carbon Steel Canister-Bentonite-Granite). Deliverable D5.1.1. Part 1.
8. ENRESA, 2006. FEBEX Project Final Report: Final THG Modelling Report. ENRESA Technical Publication. PT 05-3/2006, 165 pp.
9. Faivre D., Agrinier P., Menguy N., Zuddas P., Pachana K., Gloter A., Laval J.-Y., Guyot F. Mineralogical and isotopic properties of inorganic nanocrystalline magnetites. Geochimica et Cosmochimica Acta 2004, 68(21):4395-4403.
10. Fernández A.M., Baeyens B., Bradbury M., Rivas P. Analysis of the pore water chemical composition of a Spanish compacted bentonite used in an engineered barrier. Physics and Chemistry of the Earth 2004, 29:105-118.
11. Gérard F., Clement A., Fritz B. Numerical validation of a Eulerian hydrochemical code using a 1D multisolute mass transport system involving heterogeneous kinetically controlled reactions. Journal of Contaminant Hydrology 1998, 30:201-216.
12. Idemitsu K., Yano S., Xia X., Inagaki Y., Arima T., Mitsugashira T., Hara M., Suzuki Y. Diffusion behavior of iron corrosion products in buffer materials. Materials Research Society Symposia Proceedings 2002, 713:113-120.
13. Marty N., Fritz B., Clément A., Michau N. Modelling the long term alteration of the engineered bentonite barrier in an underground radioactive waste repository. Applied Clay Sci. 2010, 47(1-2):82-90. 10.1016/j.clay.2008.10.002.
14. Missana T., Turrero M.J., Adell A. Surface charge and electrophoretic properties of colloids obtained from homoionic and natural bentonite. Materials Research Society Symposia Proceedings 1999, 608:255-266.
15. Molinero J., Samper J. Modeling of reactive solute transport in fracture zones of granitic bedrocks. Journal of Contaminant Hydrology 2006, 82:293-318.
16. Montes H.G., Fritz B., Clement A., Michau N. Modeling of transport and reaction in an engineered barrier for radioactive waste confinement. Applied Clay Science 2005, 29:155-171.
17. Montes H.G., Marty N., Fritz B., Clement A., Michau N. Modeling of long-term diffusion-reaction in a bentonite barrier for radioactive waste confinement. Applied Clay Science 2005, 30:181-198.
18. Samper J., Lu C., Montenegro L. Coupled hydrogeochemical calculations of the interactions of corrosion products and bentonite. Physics and Chemistry of the Earth 2008, 33(Suppl. 1):S306-S316. 10.1016/j.pce.2008.10.009.
19. Samper J., Zheng L., Fernández A.M., Montenegro L. Inverse modeling of multicomponent reactive transport through single and dual porosity media. Journal of Contaminant Hydrology 2008, 98(3-4):115-127.
20. Samper J., Zheng L., Montenegro L., Fernández A.M., Rivas P. Testing coupled thermo-hydro-chemical models of compacted bentonite after dismantling the FEBEX in situ test. Applied Geochemistry 2008, 23(5):1186-1201. 10.1016/j.apgeochem.2007.11.010.
21. 2D Version 4: A Code for Non-Isothermal Water Flow and Reactive Solute Transport. Users Manual 2003, University of La Coruña, Spain.
22. Samper J., Lu C., Cormenzana J.L., Cuñado M.A., Ma H., Montenegro L. Benchmark Calculations in Granite. PAMINA Project, Deliverable 4.1.2 2009, University of A Coruña, Spain.
23. Samper, J., Xu, T., Yang, C., 2009b. A sequential partly iterative approach for multicomponent reactive transport with CORE2D. Computational Geosciences. doi: 10.1007/s10596-008-9119-5.
24. Samper J., Lu C., Cormenzana J.L., Ma H., Montenegro L., Cuñado M.A. Testing Kd models of Cs+ in the near field of a HLW repository in granite with a reactive transport model. Physics and Chemistry of the Earth 2010, 35:278-283. 10.1016/j.pce.2010.04.002.
25. Smart, NR., Blackwood, DJ., Werme, L., 2001. The anaerobic corrosion of carbon steel and cast iron in artificial groundwater. SKB Technical Report TR-01-22.
26. Smart, N.R., Carlson, L., Hunter, F.M.I., Karnland, O., Pritchard, A.M., Rance, A.P., Werme, L.O., 2006. Interactions between iron corrosion products and bentonite. NF-PRO Report WP2.3/D2.3.5.
27. Tournassat C. Cations-clay interactions: The Fe(II) case. Application to the problematic of the French deep nuclear repository field concept. Ph.D. Dissert 2003, Grenoble, France.
28. Wolery, T.J., 1992. EQ3/6, a software package for geochemical modeling of aqueous systems: Package overview and installation guide (version 7.0). Technical Report UCRL-MA-110662-Pt 1. Lawrence Livermore National Laboratory, CA, USA.
29. Xia X., Idemitsu K., Arima T., Inagaki Y., Ishidera T., Kurosawa S., Iijima K., Sato H. Corrosion of carbon steel in compacted bentonite and its effect on neptunium diffusion under reducing condition. Applied Clay Science 2005, 28:89-100.
30. Xu T., Samper J., Ayora C., Manzano M., Custodio E. Modeling of non-isothermal multicomponent reactive transport in field scale porous media flow systems. Journal of Hydrology 1999, 214:144-164.
31. Yang C., Samper J., Montenegro L. A coupled non-isothermal reactive transport model for long-term geochemical evolution of a HLW repository in clay. Environmental Geology 2008, 53:1627-1638. 10.1007/s00254-007-0770-2.
32. Zheng L., Samper J. Coupled THMC model of FEBEX mock-up test. Physics and Chemistry of the Earth 2008, 33:S486-S498. 10.1016/j.pce.2008.10.023.
33. Zheng L., Samper J., Montenegro L., Mayor J.C. Flow and reactive transport model of a ventilation experiment in Opallinus clay. Physics and Chemistry of the Earth 2008, 33(14-16):1009-1018. 10.1016/j.pce.2008.05.012.
34. Zheng, L, Samper, J., Montenegro, L., Fernández, AM., 2010. A coupled THMC model of a heating and hydration laboratory experiment in unsaturated compacted FEBEX bentonite. Journal of Hydrology. doi: 10.1016/j.jhydrol.2010.03.009.