Building up accurate atomistic models of biofunctionalized magnetite nanoparticles from first-principles calculations

Abstract Biofunctionalized magnetite nanoparticles offer unique multifunctional capabilities that can drive nanomedical innovations. Designing synthetic bioorganic coatings and controlling their molecular behavior is crucial for achieving superior performance. However, accurately describing the inte...

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Bibliographic Details
Main Authors: Paulo Siani, Enrico Bianchetti, Cristiana Di Valentin
Format: Article
Language:English
Published: Nature Portfolio 2025-01-01
Series:npj Computational Materials
Online Access:https://doi.org/10.1038/s41524-024-01476-3
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