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POBERŽNIK, Matic, COSTA, Dominique, HEMERYCK, Anne, KOKALJ, Anton. Insight into the bonding of silanols to oxidized aluminum surfaces. The Journal of Physical Chemistry. C, Nanomaterials and interfaces, ISSN 1932-7447, 2018, vol. 122, no. 17, str. 9417-9431, doi: 10.1021/acs.jpcc.7b12552. [COBISS.SI-ID 31359783].
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POBERŽNIK, Matic, KOKALJ, Anton. Origin of surprising attractive interactions between electronegative oxygen adatoms on aluminum surfaces. The Journal of Physical Chemistry. C, Nanomaterials and interfaces, ISSN 1932-7447, 2016, vol. 120, no. 45, str. 25915-25922, doi: 10.1021/acs.jpcc.6b08894. [COBISS.SI-ID 29992743].
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KOKALJ, Anton. Ab initio modeling of the bonding of benzotriazole corrosion inhibitor to reduced and oxidized copper surfaces. Faraday Discussions, ISSN 1359-6640, 2015, vol. 180, str. 415-438, doi: 10.1039/C4FD00257A. [COBISS.SI-ID 28748327].
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KOKALJ, Anton, COSTA, Dominique. Molecular modeling of corrosion inhibitors. V: WANDELT, Klaus (ur.). Encyclopedia of interfacial chemistry : surface science and electrochemistry. Oxford: Elsevier. 2018, str. 332-345, doi: 10.1016/B978-0-12-409547-2.13444-4. [COBISS.SI-ID 31421735].
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KOKALJ, Anton. Computer-aided design of the reaction site in heterogeneous catalysis. V: MEYERS, Robert A. (ur.). Encyclopedia of complexity and systems science, (SpringerLink). New York: Springer, 2014, str. 1-41, doi: 10.1007/978-3-642-27737-5_89-3. [COBISS.SI-ID 28690215].
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