Surface Characterization of Colloidal Silica Nanoparticles by Second Harmonic Scattering: Quantifying the Surface Potential and Interfacial Water Order
Marchioro, Arianna, Bischoff, Marie, Lütgebaucks, Cornelis, Biriukov, Denys, Předota, Milan, Roke, Sylvie
Published in Journal of physical chemistry. C (22.08.2019)
Published in Journal of physical chemistry. C (22.08.2019)
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Journal Article
ReaxFF molecular dynamics of graphene oxide/NaCl aqueous solution interfaces
Akbarzadeh, Rokhsareh, P edota, Milan
Published in Physical chemistry chemical physics : PCCP (17.01.2024)
Published in Physical chemistry chemical physics : PCCP (17.01.2024)
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Journal Article
Zeta Potential Determination from Molecular Simulations
Biriukov, Denys, Fibich, Pavel, Předota, Milan
Published in Journal of physical chemistry. C (06.02.2020)
Published in Journal of physical chemistry. C (06.02.2020)
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Journal Article
Dielectric Properties of Water at Rutile and Graphite Surfaces: Effect of Molecular Structure
Parez, Stanislav, Předota, Milan, Machesky, Michael
Published in Journal of physical chemistry. C (06.03.2014)
Published in Journal of physical chemistry. C (06.03.2014)
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Journal Article
Investigation of structural, electronic and optical properties of potassium and lithium based ternary Selenoindate: Using first principles approach
Khan, Muhammad Salman, Alshahrani, Thamraa, Haq, Bakhtiar Ul, Azam, Sikander, Khan, Gulzar, Alrobei, Hussein, Abbas, Zeesham, Předota, Milan, Khan, Muhammad Adil, Benaadad, Merieme
Published in Journal of solid state chemistry (01.01.2021)
Published in Journal of solid state chemistry (01.01.2021)
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Journal Article
Oxalic Acid Adsorption on Rutile: Experiments and Surface Complexation Modeling to 150 °C
Machesky, Michael L, Ridley, Moira K, Biriukov, Denys, Kroutil, Ondřej, Předota, Milan
Published in Langmuir (18.06.2019)
Published in Langmuir (18.06.2019)
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Journal Article
Clinoptilolite/electrolyte interface probed by a classical molecular dynamics simulations and batch adsorption experiments
Kroutil, Ondřej, Nguyen, Vinh D., Volánek, Jiří, Kučera, Aleš, Předota, Milan, Vranová, Valerie
Published in Microporous and mesoporous materials (01.12.2021)
Published in Microporous and mesoporous materials (01.12.2021)
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Journal Article
Local molecular environment drives speciation and reactivity of ion complexes in concentrated salt solution
Rampal, Nikhil, Wang, Hsiu-Wen, Biriukov, Denys, Brady, Alexander B., Neuefeind, Joerg C., Předota, Milan, Stack, Andrew G.
Published in Journal of molecular liquids (15.10.2021)
Published in Journal of molecular liquids (15.10.2021)
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Journal Article
Force field parametrization of hydrogenoxalate and oxalate anions with scaled charges
Kroutil, Ondřej, Předota, Milan, Kabeláč, Martin
Published in Journal of molecular modeling (01.11.2017)
Published in Journal of molecular modeling (01.11.2017)
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Journal Article
Surface Protonation at the Rutile (110) Interface: Explicit Incorporation of Solvation Structure within the Refined MUSIC Model Framework
Machesky, Michael L, Předota, Milan, Wesolowski, David J, Vlcek, Lukas, Cummings, Peter T, Rosenqvist, Jörgen, Ridley, Moira K, Kubicki, James D, Bandura, Andrei V, Kumar, Nitin, Sofo, Jorge O
Published in Langmuir (04.11.2008)
Published in Langmuir (04.11.2008)
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Journal Article
Comparison of Cation Adsorption by Isostructural Rutile and Cassiterite
Machesky, Michael, Wesolowski, David, Rosenqvist, Jörgen, Předota, Milan, Vlcek, Lukas, Ridley, Moira, Kohli, Vaibhav, Zhang, Zhan, Fenter, Paul, Cummings, Peter, Lvov, Serguei, Fedkin, Mark, Rodriguez-Santiago, Victor, Kubicki, James, Bandura, Andrei
Published in Langmuir (19.04.2011)
Published in Langmuir (19.04.2011)
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