Adaptive ionic moieties for electrolyte structural design

Ionic liquids (ILs) are now an established and ubiquitous material class. In energy applications and electroresponsive lubrication, their interfacial self-assembly is crucial for their properties. This in turn is determined by chemical structure and a local hierarchy of Coulombic, van der Waals, and solvophobic interactions. We hypothesize that delocalization of the ionic charge permits the Coulombic interactions to adapt to other self-assembly imperatives, promoting both bulk and interfacial self-assembly structures and enhancing double layer responses. Novel chelated bis(catecholato)borate anion architectures are introduced, with [P 66614 ] cations. Small/wide-angle x-ray scattering of the ILs indicates pronounced cation assemblies. In the electrolyte solvent propylene carbonate, small-angle neutron scattering shows marked anion-dependent self-assembly modulation. Neutron reflectivity reveals analogous response in the electrochemical double layer; the catechols form thicker and more electroresponsive interfacial layers. Density functional theory calculations demonstrate electronic resonance, modulating the anion polarizability. This direct self-assembly control broadly affects electrochemistry, lubrication, and formulation design.

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Publication Details

Journal
Science Advances
Published
2026-09-25
DOI
https://doi.org/10.1126/sciadv.aeh0276
Primary Topic
Ionic liquids properties and applications
Type
article
Field-Weighted Citation Impact
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article

Adaptive ionic moieties for electrolyte structural design

Serena Cozzolino, Liliana de Campo, Daniel C. Morris, Oliver S. Hammond et al.
Science Advances
Ionic liquids properties and applications
article

Adaptive ionic moieties for electrolyte structural design

Serena Cozzolino, Liliana de Campo, Daniel C. Morris, Oliver S. Hammond, Oleg N. Antzutkin, Sergei B. Glavatskih, Anja‐Verena Mudring, Jason Brian Harper, Guillaume Bousrez, Sichao Li, Mark William Rutland, Andrew E. Whitten, Andrew R. J. Nelson, Stuart J. Brown, Alexei Vorobiev, Manishkumar Shimpi
article en

Abstract

Ionic liquids (ILs) are now an established and ubiquitous material class. In energy applications and electroresponsive lubrication, their interfacial self-assembly is crucial for their properties. This in turn is determined by chemical structure and a local hierarchy of Coulombic, van der Waals, and solvophobic interactions. We hypothesize that delocalization of the ionic charge permits the Coulombic interactions to adapt to other self-assembly imperatives, promoting both bulk and interfacial self-assembly structures and enhancing double layer responses. Novel chelated bis(catecholato)borate anion architectures are introduced, with [P 66614 ] cations. Small/wide-angle x-ray scattering of the ILs indicates pronounced cation assemblies. In the electrolyte solvent propylene carbonate, small-angle neutron scattering shows marked anion-dependent self-assembly modulation. Neutron reflectivity reveals analogous response in the electrochemical double layer; the catechols form thicker and more electroresponsive interfacial layers. Density functional theory calculations demonstrate electronic resonance, modulating the anion polarizability. This direct self-assembly control broadly affects electrochemistry, lubrication, and formulation design.

Science AdvancesVol. 12(39)
École Centrale de Lyon (FR), Uppsala University (SE), HOGENT University of Applied Sciences and Arts (BE), Australian Nuclear Science and Technology Organisation (AU), Stockholm University (SE), Luleå University of Technology (SE), Aarhus University (DK), RISE Research Institutes of Sweden (SE), UNSW Sydney (AU), Ghent University (BE), University Hospital of Umeå (SE), Institut Laue-Langevin (FR), Wallenberg Wood Science Center (SE), Umkhuseli Innovation and Research Management (ZA), KTH Royal Institute of Technology (SE), Umeå University (SE), University of KwaZulu-Natal (ZA)
Affordable and clean energy
Openalex Percentile: Top 32%
Ionic liquids properties and applications
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