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Probing Molecular Interactions at MXene-Organic Heterointerfaces
Journal article   Open access   Peer reviewed

Probing Molecular Interactions at MXene-Organic Heterointerfaces

Muhammad Boota, Chi Chen, Long Yang, Alexander Kolesnikov, Naresh C. Osti, William Porzio, Luisa Barba and Jianjun Jiang
Chemistry of materials, v 32(18), pp 7884-7894
22 Sep 2020
url
https://www.osti.gov/biblio/1669745View

Abstract

Chemistry Chemistry, Physical Materials Science, Multidisciplinary Science & Technology Materials Science Physical Sciences Technology
Here, using a combined theoretical and experimental approach, we have investigated the interaction mechanism of titanium carbide MXene with a variety of organic molecules whose end groups are O, S, N, and tertiary amines. All organic molecules intercalated between MXene layers; however, layer expansion followed the end group of the organic molecules. A broad range of optical spectroscopies confirmed that the nature of interactions/reactions of titanium carbide MXene with organic molecules is also end group-dependent that involve a variety of complex interactions between MXene and organic molecules such as electrostatic interactions, polymerization, strong binding, and in some cases catalytic decomposition of the organic molecules. First-principles calculations revealed that organic molecules tend to stay flat on the MXene surface during molecular assembly and that the binding and charge transfer from organic molecules to MXene occur, which are strongly end group-dependent, corroborating the experimental observations. The impact of interactions/reactions within the MXene-organic heterostructures on pseudocapacitance is further discussed.

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Collaboration types
Domestic collaboration
International collaboration
Web of Science research areas
Chemistry, Physical
Materials Science, Multidisciplinary
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