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- W2322387688 abstract "The S = 11 ground states of the Mn7 family of mixed-valence complexes with a metal-centered hexagonal topology have been found by density functional theory calculations to arise by spin frustration involving small differences in the magnitudes of the two weakest interactions controlling the alignment of the central spin. Targeted structural perturbation has allowed a complex with the central spin flipped to be discovered, which thus possesses the maximum S = 16 ground state." @default.
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- W2322387688 date "2008-06-28" @default.
- W2322387688 modified "2023-09-27" @default.
- W2322387688 title "Spin Maximization: Switching of the Usual <i>S</i> = 11 State of Mn<sup>II</sup><sub>4</sub>Mn<sup>III</sup><sub>3</sub> Disklike Complexes to the Maximum <i>S</i> = 16" @default.
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- W2322387688 doi "https://doi.org/10.1021/ic801024d" @default.
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