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2018

Nerut, Eva Roos and Karu, Karl and Voroshylova, Iuliia V. and Kirchner, Kathleen and Kirchner, Tom and Fedorov, Maxim V. and Ivaništšev, Vladislav B. (2018) NaRIBaS-a scripting framework for computational modeling of nanomaterials and room temperature ionic liquids in bulk and slab. Computation, 6 (4). 57. ISSN 1866-9964

2013

Kirchner, K. and Kirchner, T. and Ivaništšev, V. and Fedorov, M.V. (2013) Electrical double layer in ionic liquids : structural transitions from multilayer to monolayer structure at the interface. Electrochimica Acta, 110. pp. 762-771. ISSN 0013-4686

Asmadi, A. and Kirchner, T. and Abdallah, W. and Fedorov, M.V. and Stukan, M.R. (2013) Influence of the Drude charge value on the performance of polarisable water model : a test for microscopic and macroscopic parameters. Journal of Molecular Liquids, 188. pp. 245-251. ISSN 0167-7322

2012

Frolov, Andrey I. and Kirchner, Kathleen and Kirchner, Tom and Fedorov, Maxim V. (2012) Molecular-scale insights into the mechanisms of ionic liquids interactions with carbon nanotubes. Faraday Discussions, 154. pp. 235-247. ISSN 1359-6640

2011

Frolov, Andrey I. and Kirchner, Tom and Kirchner, Kathleen and Fedorov, Maxim V. (2011) Interactions of ionic liquids and their mixtures with carbon nanomaterials: insights from molecular modeling. Abstracts of papers - American Chemical Society, 242. -. ISSN 0065-7727