Uncovers challenges for ytterbium(III)-based magnets under zero-field, indicating the need for new approaches.
Yb(III)-based single-molecule magnets (SMMs) have remained conspicuously absent under zero-field conditions, appearing only with applied dc fields or under diamagnetic dilution. Utilising both CASSCF and CASPT2 methodologies, we systematically investigate...
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Fagundes et al. (2026) studied this question.
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