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@ARTICLE{Poonoosamy:903490,
      author       = {Poonoosamy, J. and Wanner, C. and Alt Epping, P. and
                      Águila, J. F. and Samper, J. and Montenegro, L. and Xie, M.
                      and Su, D. and Mayer, K. U. and Mäder, U. and Van Loon, L.
                      R. and Kosakowski, G.},
      title        = {{B}enchmarking of reactive transport codes for 2{D}
                      simulations with mineral dissolution–precipitation
                      reactions and feedback on transport parameters},
      journal      = {Computational geosciences},
      volume       = {25},
      number       = {4},
      issn         = {1420-0597},
      address      = {Bussum},
      publisher    = {Baltzer Science Publ.},
      reportid     = {FZJ-2021-05162},
      pages        = {1337 - 1358},
      year         = {2021},
      abstract     = {Porosity changes due to mineral dissolution–precipitation
                      reactions in porous media and the resulting impact on
                      transport parameters influence the evolution of natural
                      geological environments or engineered underground barrier
                      systems. In the absence of long-term experimental studies,
                      reactive transport codes are used to evaluate the long-term
                      evolution of engineered barrier systems and waste disposal
                      in the deep underground. Examples for such problems are the
                      long-term fate of CO2 in saline aquifers and mineral
                      transformations that cause porosity changes at
                      clay–concrete interfaces. For porosity clogging under a
                      diffusive transport regime and for simple reaction networks,
                      the accuracy of numerical codes can be verified against
                      analytical solutions. For clogging problems with more
                      complex chemical interactions and transport processes,
                      numerical benchmarks are more suitable to assess model
                      performance, the influence of thermodynamic data, and
                      sensitivity to the reacting mineral phases. Such studies
                      increase confidence in numerical model descriptions of more
                      complex, engineered barrier systems. We propose a reactive
                      transport benchmark, considering the advective–diffusive
                      transport of solutes; the effect of liquid-phase density on
                      liquid flow and advective transport; kinetically controlled
                      dissolution–precipitation reactions causing porosity,
                      permeability, and diffusivity changes; and the formation of
                      a solid solution. We present and analyze the results of five
                      participating reactive transport codes (i.e., CORE2D,
                      MIN3P-THCm, OpenGeoSys-GEM, PFLOTRAN, and TOUGHREACT). In
                      all cases, good agreement of the results was obtained.},
      cin          = {IEK-6},
      ddc          = {550},
      cid          = {I:(DE-Juel1)IEK-6-20101013},
      pnm          = {1411 - Nuclear Waste Disposal (POF4-141)},
      pid          = {G:(DE-HGF)POF4-1411},
      typ          = {PUB:(DE-HGF)16},
      UT           = {WOS:000678376200004},
      doi          = {10.1007/s10596-018-9793-x},
      url          = {https://juser.fz-juelich.de/record/903490},
}