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101 0 |
SM ISO690:2012 KLOKISHNER, Sophia I., ROMAN, Marianna, REU, Oleg. A model of spin crossover in manganese(III) compounds: Effects of intra- and intercenter interactions. In: Inorganic Chemistry, 2011, vol. 50, pp. 11394-11402. ISSN 0020-1669. DOI: https://doi.org/10.1021/ic201025u |
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Inorganic Chemistry | ||||||
Volumul 50 / 2011 / ISSN 0020-1669 | ||||||
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DOI:https://doi.org/10.1021/ic201025u | ||||||
Pag. 11394-11402 | ||||||
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A microscopic approach to the problem of cooperative spin crossover in the [MnL2]NO3 crystal, which contains MnIII ions as structural units, is elaborated on, and the main mechanisms governing this effect are revealed. The proposed model also takes into account the splitting of the low-spin 3T1 (t24) and high-spin 5E (t23e) terms by the low-symmetry crystal field. The low-spin → high-spin transition has been considered as a cooperative phenomenon driven by interaction of the electronic shells of the MnIII ions with the all-around full-symmetric deformation that is extended over the crystal lattice via the acoustic phonon field. The model well explains the observed thermal dependencies of the magnetic susceptibility and the effective magnetic moment. |
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