Contrasting Effects of Functionalization in Binary and Medium-Entropy MXene Coatings for Corrosion Protection

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Hauptverfasser: Fayyaz, Aqsa, Diaz, Ulises Martin, Dai, Jianyu, Castaneda, Homero, Wu, Chenglin
Format: Preprint
Veröffentlicht: 2026
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author Fayyaz, Aqsa
Diaz, Ulises Martin
Dai, Jianyu
Castaneda, Homero
Wu, Chenglin
author_facet Fayyaz, Aqsa
Diaz, Ulises Martin
Dai, Jianyu
Castaneda, Homero
Wu, Chenglin
contents Developing scalable and environmentally benign anticorrosion coatings is critical for protecting steel infrastructure in chloride-rich environments. Here, a nacre-inspired multilayer epoxy coating reinforced with four MXene systems is investigated. This architecture forms a dense lamellar network that increases diffusion tortuosity and introduces electroactive surfaces for ion interactions. Electrochemical impedance spectroscopy (EIS) confirms that the multilayer design increases coating resistance from ~103 to ~108 Ohm/cm2. A clear performance hierarchy was observed: P-(TiVCrMo)C3 > O-Ti3C2Tx > O-(TiVCrMo)C3 > P-Ti3C2Tx. Density functional theory (DFT) calculations reveal that P-Ti3C2 strongly adsorbs O2, indicating higher surface reactivity, while oxygen termination stabilizes the surface by partially passivating Ti sites. In contrast, P-(TiVCrMo)C3 exhibits strong adsorption of oxygen-containing species due to its multi-metal electronic structure, promoting the formation of protective oxides. These results highlight the delicate balance of surface chemistry, electronic structure, and compositional entropy in designing next-generation MXene-based anticorrosion coatings for marine and industrial environments.
format Preprint
id arxiv_https___arxiv_org_abs_2604_27114
institution arXiv
publishDate 2026
record_format arxiv
spellingShingle Contrasting Effects of Functionalization in Binary and Medium-Entropy MXene Coatings for Corrosion Protection
Fayyaz, Aqsa
Diaz, Ulises Martin
Dai, Jianyu
Castaneda, Homero
Wu, Chenglin
Materials Science
Developing scalable and environmentally benign anticorrosion coatings is critical for protecting steel infrastructure in chloride-rich environments. Here, a nacre-inspired multilayer epoxy coating reinforced with four MXene systems is investigated. This architecture forms a dense lamellar network that increases diffusion tortuosity and introduces electroactive surfaces for ion interactions. Electrochemical impedance spectroscopy (EIS) confirms that the multilayer design increases coating resistance from ~103 to ~108 Ohm/cm2. A clear performance hierarchy was observed: P-(TiVCrMo)C3 > O-Ti3C2Tx > O-(TiVCrMo)C3 > P-Ti3C2Tx. Density functional theory (DFT) calculations reveal that P-Ti3C2 strongly adsorbs O2, indicating higher surface reactivity, while oxygen termination stabilizes the surface by partially passivating Ti sites. In contrast, P-(TiVCrMo)C3 exhibits strong adsorption of oxygen-containing species due to its multi-metal electronic structure, promoting the formation of protective oxides. These results highlight the delicate balance of surface chemistry, electronic structure, and compositional entropy in designing next-generation MXene-based anticorrosion coatings for marine and industrial environments.
title Contrasting Effects of Functionalization in Binary and Medium-Entropy MXene Coatings for Corrosion Protection
topic Materials Science
url https://arxiv.org/abs/2604.27114