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Number of items: 9.

Ungerer, Marietjie J., van Sittert, Cornelia G. C. E. and de Leeuw, Nora H. 2021. Behavior of S, SO, and SO3 on Pt (001), (011), and (111) surfaces: a DFT study. The Journal of Chemical Physics 154 (19) , 194701. 10.1063/5.0043501
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Ungerer, Marietjie J., Santos-Carballal, David, Cadi-Essadek, Abdelaziz, van Sittert, Cornelia G. C. E. and de Leeuw, Nora H. 2020. Interaction of SO2 with the platinum (001), (011), and (111) surfaces: a DFT study. Catalysts 10 (5) , 558. 10.3390/catal10050558
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Ungerer, M. J., van Sittert, C. G. C. E., van der Westhuizen, D. J. and Krieg, H. M. 2019. DFT modelling of tantalum pentafluoride extraction with phosphorus-based extractants - A molecular dynamics study. Journal of Physics and Chemistry of Solids 135 , 109121. 10.1016/j.jpcs.2019.109121

Ungerer, Marietjie, Santos Carballal, David, Cadi, Abdelaziz, van Sittert, Cornelia G. C. E. and de Leeuw, Nora H. 2019. Interaction of H2O with the platinum Pt (001), (011), and (111) surfaces: a density functional theory study with long-range dispersion corrections. Journal of Physical Chemistry C 123 (45) , pp. 27465-27476. 10.1021/acs.jpcc.9b06136
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Ungerer, M. J., van der Westhuizen, D. J., Krieg, H. M. and van Sittert, C. G. C. E. 2019. Molecular modelling of tantalum fluoride in sulphuric acid medium: a DFT study. Journal of Molecular Liquids 288 , 111056. 10.1016/j.molliq.2019.111056

Ungerer, M. J., van Sittert, C. G. C. E., van der Westhuizen, D. J. and Krieg, H. M. 2016. Molecular modelling of tantalum penta-halides during hydrolysis and oxidation reactions. Computational and Theoretical Chemistry 1090 , pp. 112-119. 10.1016/j.comptc.2016.06.011

Ungerer, Marietjie J., van der Westhuizen, Derik J., Krieg, Henning M. and van Sittert, Cornelia G.C.E. 2014. Molecular modelling of the hydrolysis of tantalum and niobium pentafluoride. Advanced Materials Research 1019 , pp. 406-411. 10.4028/www.scientific.net/AMR.1019.406

de Beer, Leon, Ungerer, Marietjie J., van der Westhuizen, Derik J. and Krieg, Henning M. 2014. The time dependent solvent extraction of Ta and Nb. Advanced Materials Research 1019 , pp. 433-438. 10.4028/www.scientific.net/AMR.1019.433

Ungerer, M. J., van der Westhuizen, D. J., Lachmann, G. and Krieg, H. M. 2014. Comparison of extractants for the separation of TaF5 and NbF5 in different acidic media. Hydrometallurgy 144-14 , pp. 195-206. 10.1016/j.hydromet.2014.02.015

This list was generated on Mon Sep 27 23:31:49 2021 BST.