2020

  • Cametti G, Scheinost AC, Giordani M, Churakov SV
    Framework modifications and dehydration path of a Ag+-modified zeolite with STI framework type
    Journal of Physical Chemistry C. 2019; 123(22): 13651-13663. https://doi.org/10.1021/acs.jpcc.9b01976
    DORA PSI
  • Cametti G, Scheinost AC, Churakov SV
    Structural modifications and thermal stability of Cd2+-exchanged stellerite, a zeolite with STI framework type
    Journal of Physical Chemistry C. 2019; 123(41): 25236-25245. https://doi.org/10.1021/acs.jpcc.9b07297
    DORA PSI
  • Curti E, Xto J, Borca CN, Henzler K, Huthwelker T, Prasianakis NI
    Modelling Ra-bearing baryte nucleation/precipitation kinetics at the pore scale: application to radioactive waste disposal
    European Journal of Mineralogy. 2019; 31(2): 247-262. https://doi.org/10.1127/ejm/2019/0031-2818
    DORA PSI
  • Di Lorenzo F, Ruiz-Agudo C, Churakov SV
    The key effects of polymorphism during PbII uptake by calcite and aragonite
    CrystEngComm. 2019; 21(41): 6145-6155. https://doi.org/10.1039/C9CE01040H
    DORA PSI
  • Fazeli H, Patel RA, Ellis BR, Hellevang H
    Three-dimensional pore-scale modeling of fracture evolution in heterogeneous carbonate caprock subjected to CO2-enriched brine
    Environmental Science and Technology. 2019; 53(8): 4630-4639. https://doi.org/10.1021/acs.est.8b05653
    DORA PSI
  • Geng G, Li J, Zhang W, Yu Y-S, Shapiro DA, Monteiro PJM
    The hydration of β- and α′H-dicalcium silicates: an X-ray spectromicroscopic study
    ACS Sustainable Chemistry and Engineering. 2019; 7(2): 2316-2326. https://doi.org/10.1021/acssuschemeng.8b05060
    DORA PSI
  • Gimmi T, Churakov SV
    Water retention and diffusion in unsaturated clays: connecting atomistic and pore scale simulations
    Applied Clay Science. 2019; 175: 169-183. https://doi.org/10.1016/j.clay.2019.03.035
    DORA PSI
  • Giordani M, Cametti G, Di Lorenzo F, Churakov SV
    Real-time observation of fibrous zeolites reactivity in contact with simulated lung fluids (SLFs) obtained by atomic force microscope (AFM)
    Minerals. 2019; 9(2): 83 (23 pp.). https://doi.org/10.3390/min9020083
    DORA PSI
  • Guillemot T, Wieland E, Kunz D, Tits J, Salazar G, Szidat S
    Corrosion of irradiated steel in cementitious environment: speciation of carbon-14
    Presented at: 5th International workshop on mechanisms and modelling of waste / cement interaction; March 25-27, 2019; Karlsruhe, Germany.
    DORA PSI
  • Guillemot T, Stockhecke M, Bechtel A, Ladd SN, Nelson DB, Schubert CJ
    Paleoenvironmental and paleoclimatic variations around Lake Van (Eastern Turkey) recorded by sedimentary source specific biomarkers 250–130 ka (MIS7 and MIS6)
    Quaternary Science Reviews. 2019; 225: 105997 (10 pp.). https://doi.org/10.1016/j.quascirev.2019.105997
    DORA PSI
  • Guillemot T, Wieland E, Kunz D, Cvetković B
    Understanding the carbon speciation during iron corrosion in alkaline anoxic conditions for safety assessment of radioactive waste repositories
    Presented at: 7th international workshop on long-term prediction of corrosion damage in nuclear waste systems (LTC 2019); November 19-21, 2019; Nancy, France.
    DORA PSI
  • Hummel W, Filella M, Rowland D
    Where to find equilibrium constants?
    Science of the Total Environment. 2019; 692: 49-59. https://doi.org/10.1016/j.scitotenv.2019.07.161
    DORA PSI
  • Jacques D, Dauzères A, Dejssmann G, Govaerts J, Holt E, Kosakowski G, et al.
    EURAD ACED. Assessment of chemical evolution of ILW and HLW disposal cells
    Presented at: 9th European commission conference on EURATOM research and training in radioactive waste management (EURADWASTE '19); June 4-7, 2019; Pitesti, Romania.
    DORA PSI
  • Jenni A, Wersin P, Thoenen T, Baeyens B, Ferrari A, Gimmi T, et al.
    Bentonite backfill performance in a high-level waste repository: a geochemical perspective
    Wettingen: National Cooperative for the Disposal of Radioactive Waste (Nagra); 2019. Nagra: technical report: NTB 19-03.
    DORA PSI
  • Kosakowski G, Lothenbach B
    Influence of temperature pulse on a cementitious near field
    Presented at: EGU general assembly 2019; April 7-12, 2019; Vienna, Austria.
    DORA PSI
  • Krejci P, Gimmi T, Van Loon L
    Modelling diffusion of sorbing cations in Opalinus Clay
    Presented at: Goldschmidt; August 18-23, 2019; Barcelona.
    DORA PSI
  • Kéri A, Dähn R, Krack M, Churakov SV
    Characterization of structural iron in smectites — an ab initio based X-ray absorption spectroscopy study
    Environmental Science and Technology. 2019; 53(12): 6877-6886. https://doi.org/10.1021/acs.est.8b06952
    DORA PSI
  • Kéri AG
    Mechanism of metal uptake by clay minerals ― X-ray spectroscopy and molecular modelling study
    2019.
    DORA PSI
  • Li J, Geng G, Myers R, Yu Y-S, Shapiro D, Carraro C, et al.
    The chemistry and structure of calcium (alumino) silicate hydrate: a study by XANES, ptychographic imaging, and wide- and small-angle scattering
    Cement and Concrete Research. 2019; 115: 367-378. https://doi.org/10.1016/j.cemconres.2018.09.008
    DORA PSI
  • Liu X, Vinograd VL, Nichenko S, Kulik DA, Lu X, Winkler B
    Emulation of short-range ordering within the compound energy formalism: application to the calcite-magnesite solid solution
    Calphad. 2019; 64: 115-125. https://doi.org/10.1016/j.calphad.2018.11.012
    DORA PSI
  • Liu L, Sun C, Geng G, Feng P, Li J, Dähn R
    Influence of decalcification on structural and mechanical properties of synthetic calcium silicate hydrate (C-S-H)
    Cement and Concrete Research. 2019; 123: 105793 (8 pp.). https://doi.org/10.1016/j.cemconres.2019.105793
    DORA PSI
  • Lothenbach B, Kulik DA, Matschei T, Balonis M, Baquerizo L, Dilnesa B, et al.
    Cemdata18: a chemical thermodynamic database for hydrated Portland cements and alkali-activated materials
    Cement and Concrete Research. 2019; 115: 472-506. https://doi.org/10.1016/j.cemconres.2018.04.018
    DORA PSI
  • Mancini A, Wieland E, Lothenbach B, Dähn R, Wehrli B
    Fe in GGBFS: new insights from laboratory experiments and synchrotron-based investigations
    Presented at: 15th International congress on the chemistry of cement (ICCC 2019); September 16-20, 2019; Prague, Czech Republic.
    DORA PSI
  • Mancini A, Wieland E, Lothenbach B, Dähn R, Wehrli B
    Fe in GGBFS: new insights from laboratory experiments and synchrotron-based investigations
    In: Gemrich J, ed. ICCC Prague 2019 - 15th international congress on the chemistry of cement. Vol. 2. Proceedings of the 15th international congress on the chemistry of cement (ICCC 2019). Prague: Research Institute of Binding Materials Prague; 2019:(6 pp.).
    DORA PSI
  • Marques Fernandes M, Baeyens B
    Cation exchange and surface complexation of lead on montmorillonite and illite including competitive adsorption effects
    Applied Geochemistry. 2019; 100: 190-202. https://doi.org/10.1016/j.apgeochem.2018.11.005
    DORA PSI
  • Miron GD, Leal AMM, Yapparova A
    Thermodynamic properties of aqueous species calculated using the HKF model: How do different thermodynamic and electrostatic models for solvent water affect calculated aqueous properties?
    Geofluids. 2019; 2019: 5750390 (24 pp.). https://doi.org/10.1155/2019/5750390
    DORA PSI
  • Monteiro PJM, Geng G, Marchon D, Li J, Alapati P, Kurtis KE, et al.
    Advances in characterizing and understanding the microstructure of cementitious materials
    Cement and Concrete Research. 2019; 124: 105806 (29 pp.). https://doi.org/10.1016/j.cemconres.2019.105806
    DORA PSI
  • Nedyalkova L, Lothenbach B, Tits J, Wieland E, Mäder U
    Effect of redox conditions on sulfur and selenium binding in AFm phases
    In: Altmaier M, Montoya V, Duro L, Valls A, eds. Proceedings of the second workshop of the Horizon 2020 CEBAMA Project. Vol. 7752. KIT scientific reports. Karlsruhe: KIT Scientific Publishing; 2019:219-227. https://doi.org/10.5445/KSP/1000084618
    DORA PSI
  • Nedyalkova L, Lothenbach B, Renaudin G, Mäder U, Tits J
    Effect of redox conditions on the structure and solubility of sulfur- and selenium-AFm phases
    Cement and Concrete Research. 2019; 123: 105803 (14 pp.). https://doi.org/10.1016/j.cemconres.2019.105803
    DORA PSI
  • Nedyalkova L, Lothenbach B, Wieland E, Mäder U, Tits J
    Iodine uptake by AFm phases
    Presented at: 5th international workshop on mechanisms and modelling of waste / cement interaction; March 25-27, 2019; Karlsruhe, Germany.
    DORA PSI
  • Phung QT, Seetharam S, Perko J, Maes N, Jacques D, Liu S, et al.
    Long-term performance of cementitious materials used in nuclear waste disposal - a case study at SCK•CEN
    In: Caspeele R, Taerwe L, Frangopol DM, eds. Life-cycle analysis and assessment in civil engineering: towards an integrated vision. Life-cycle of civil engineering systems. sine loco: Taylor & Francis; 2019:619-627.
    DORA PSI
  • Poonoosamy J, Westerwalbesloh C, Deissmann G, Mahrous M, Curti E, Churakov SV, et al.
    A microfluidic experiment and pore scale modelling diagnostics for assessing mineral precipitation and dissolution in confined spaces
    Chemical Geology. 2019; 528: 119264 (16 pp.). https://doi.org/10.1016/j.chemgeo.2019.07.039
    DORA PSI
  • Poonoosamy J, Deissmann G, Mahrous M, Curti E, Churakov S, Klinkenberg M, et al.
    A microfluidic experiment and pore scale modelling for assessing mineral precipitation and dissolution in confined spaces
    Presented at: Goldschmidt 2019; August 18-23, 2019; Barcelona, Spain.
    DORA PSI
  • Safi MA, Mantzaras J, Prasianakis NI, Lamibrac A, Büchi FN
    A pore-level direct numerical investigation of water evaporation characteristics under air and hydrogen in the gas diffusion layers of polymer electrolyte fuel cells
    International Journal of Heat and Mass Transfer. 2019; 129: 1250-1262. https://doi.org/10.1016/j.ijheatmasstransfer.2018.10.042
    DORA PSI
  • Shi Z, Geng G, Leemann A, Lothenbach B
    Synthesis, characterization, and water uptake property of alkali-silica reaction products
    Cement and Concrete Research. 2019; 121: 58-71. https://doi.org/10.1016/j.cemconres.2019.04.009
    DORA PSI
  • Soler JM, Steefel CI, Gimmi T, Leupin OX, Cloet V
    Modeling the ionic strength effect on diffusion in clay. The DR-A experiment at Mont Terri
    ACS Earth and Space Chemistry. 2019; 3(3): 442-451. https://doi.org/10.1021/acsearthspacechem.8b00192
    DORA PSI
  • Tits J, Wieland E
    Formate and acetate stability under repository relevant conditions: what can we learn from the literature?
    Presented at: 5th International workshop on mechanisms and modelling of waste / cement interaction; March 25-27, 2019; Karlsruhe, Germany.
    DORA PSI
  • Yang Y, Patel RA, Churakov SV, Prasianakis NI, Kosakowski G, Wang M
    Multiscale modeling of ion diffusion in cement paste: electrical double layer effects
    Cement and Concrete Composites. 2019; 96: 55-65. https://doi.org/10.1016/j.cemconcomp.2018.11.008
    DORA PSI
  • Yapparova A, Miron GD, Kulik DA, Kosakowski G, Driesner T
    An advanced reactive transport simulation scheme for hydrothermal systems modelling
    Geothermics. 2019; 78: 138-153. https://doi.org/10.1016/j.geothermics.2018.12.003
    DORA PSI
  • Zhou Y, Orozco CA, Duque-Redondo E, Manzano H, Geng G, Feng P, et al.
    Modification of poly(ethylene glycol) on the microstructure and mechanical properties of calcium silicate hydrates
    Cement and Concrete Research. 2019; 115: 20-30. https://doi.org/10.1016/j.cemconres.2018.10.001
    DORA PSI