GEM-Selektor geochemical modeling package: revised algorithm and GEMS3K numerical kernel for coupled simulation codes
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“Thermodynamic modelling was done using the Gibbs free energy minimization program GEMS [27,28] with thermodynamic data from the PSI-GEMS database [29,30] supplemented by cement specific data [31,32].”
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- Authors
- Kulik, D. A., Wagner, T., Dmytrieva, S. V., Kosakowski, G., Hingerl, F. F., Chudnenko, K. V., & Berner, U. R.
- Affiliations
- Paul Scherrer Institute (CH)
- ETH Zurich (CH)
- The Institute of Environmental Geochemistry of National Academy of Sciences of Ukraine (UA)
- Corresponding author
- Kulik, Dmitrii A.
- Venue
- Computational Geosciences
- Published
- 2012-08-24
- ISSN
- 1420-0597 (ISSN-L)
- 1573-1499
- OpenAlex
- W2085016580
- Cited by
- 936
- References
- 61
- Citations by year
- 2026: 37 · 2025: 99 · 2024: 124 · 2023: 104 · 2022: 98 · 2021: 88 · 2020: 89 · 2019: 48 · 2018: 71 · 2017: 62 · 2016: 33 · 2015: 34 · 2014: 27 · 2013: 18 · 2012: 4
- FWCI
- 21.97
- Type
- journal article
- Language
- en
- Open access
- bronze
- doi.org
- Licence
- www.springer.com/tdm (tdm)
- Locations
- Computational Geosciences (publishedVersion)
- reroDoc Digital Library (submittedVersion)
- DORA PSI (Paul Scherrer Institute) (submittedVersion, other-oa)
- Repository for Publications and Research Data (ETH Zurich) (submittedVersion, other-oa)
- ETH Zürich Research Collection
- Topics
- Physical Sciences › Environmental Science › Environmental Engineering › Groundwater flow and contamination studies
- Physical Sciences › Environmental Science › Environmental Engineering › CO2 Sequestration and Geologic Interactions
- Physical Sciences › Earth and Planetary Sciences › Geochemistry and Petrology › Groundwater and Isotope Geochemistry
- Keywords
- geochemical modeling, interior point methods, operator splitting, chemical equilibrium, non-ideal solutions, high-performance computing
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