Findings demonstrate effective stabilization and magnetic coupling in Gd-based metallofullerenes, suggesting new material designs.
as calculated by BS-DFT. Our findings demonstrate that endo/on-cage boron doping is an effective strategy to stabilize redox-active Gd-based metallofullerenes and engineer strong magnetic coupling. The discovery of the 3c-1e bond in trimetallofullerenes opens up new possibilities for the design and construction of diverse high-performance molecular magnetic materials.
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Lu et al. (2026) studied this question.
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