Front Cover: Three Single-Ion Magnet Candidates from Erbium(III) Squarate Complexes in Relation with a Square-Antiprismatic Coordination Structure (Eur. J. Inorg. Chem. 23/2025)

IF 2 4区 化学 Q3 CHEMISTRY, INORGANIC & NUCLEAR
Rina Takano, Yasutaka Kitagawa, Takayuki Ishida
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引用次数: 0

Abstract

The Front Cover shows the result of CAS calculations performed on the discrete neutral molecule [Er(sq)(Hsq)(H2O)6]. The energy gap between the ground and first excited Kramers doublets was evaluated based on two types of structural modifications to the ErO8 square antiprism: (1) Isotropic expansion and contraction, where contraction leads to a larger gap, as expected from the stronger crystal field. (2) Anisotropic compression and elongation along the principal axis, both of which result in a wider energy gap. More information can be found in the Research Article by T. Ishida and co-workers (DOI: 10.1002/ejic.202500184).

Abstract Image

封面:铒(III)方形配合物中与方形反棱镜配位结构相关的三种候选单离子磁铁(Eur。j . Inorg。化学23/2025)
前封面显示了对离散中性分子[Er(sq)(Hsq)(H2O)6]进行CAS计算的结果。基于对ErO8方形反棱镜的两种结构修改,计算了基态和第一激发克莱默斯双重态之间的能隙:(1)各向同性膨胀和收缩,其中收缩导致更大的能隙,这与强晶体场的预期一致。(2)轴向各向异性压缩和伸长,两者都导致了更大的能隙。更多信息可以在T. Ishida及其同事的研究文章中找到(DOI: 10.1002/ejic.202500184)。
本文章由计算机程序翻译,如有差异,请以英文原文为准。
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来源期刊
European Journal of Inorganic Chemistry
European Journal of Inorganic Chemistry 化学-无机化学与核化学
CiteScore
4.30
自引率
4.30%
发文量
419
审稿时长
1.3 months
期刊介绍: The European Journal of Inorganic Chemistry (2019 ISI Impact Factor: 2.529) publishes Full Papers, Communications, and Minireviews from the entire spectrum of inorganic, organometallic, bioinorganic, and solid-state chemistry. It is published on behalf of Chemistry Europe, an association of 16 European chemical societies. The following journals have been merged to form the two leading journals, European Journal of Inorganic Chemistry and European Journal of Organic Chemistry: Chemische Berichte Bulletin des Sociétés Chimiques Belges Bulletin de la Société Chimique de France Gazzetta Chimica Italiana Recueil des Travaux Chimiques des Pays-Bas Anales de Química Chimika Chronika Revista Portuguesa de Química ACH—Models in Chemistry Polish Journal of Chemistry The European Journal of Inorganic Chemistry continues to keep you up-to-date with important inorganic chemistry research results.
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