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自旋轨道耦合 d 和 d 离子中的通用单离子物理。

Universal Single-Ion Physics in Spin-Orbit-Coupled d and d Ions.

出版信息

Inorg Chem. 2018 Nov 19;57(22):14443-14449. doi: 10.1021/acs.inorgchem.8b02718. Epub 2018 Nov 5.

Abstract

We have identified six new 4d and 4d compounds with isolated RuCl octahedra, with formulas (HMA)RuCl·Cl (1; MA = methylamine), (HGly)RuCl·Cl (2; gly = glycine), (HGly)RuCl·2HO (3), (NH)RuCl (4), (HPy)RuCl (5; py = pyridine), and H(4,4'-bpy)RuCl (6; 4,4'-bpy = 4,4'-bipyridine). We find that the temperature-dependent magnetization is well described by single-ion physics in the presence of spin-orbit coupling and negligible superexchange interactions. Further, we find that many compounds in the literature are also well described by single-ion physics, and our results demonstrate the importance of considering single-ion physics when evaluating candidate geometric frustrated magnets in the presence of spin-orbit coupling.

摘要

我们已经确定了六个具有孤立 RuCl 八面体的新型 4d 和 4d 化合物,其分子式为(HMA)RuCl·Cl(1;MA = 甲胺)、(HGly)RuCl·Cl(2;gly = 甘氨酸)、(HGly)RuCl·2HO(3)、(NH)RuCl(4)、(HPy)RuCl(5;py = 吡啶)和 H(4,4'-bpy)RuCl(6;4,4'-bpy = 4,4'-联吡啶)。我们发现,在存在自旋轨道耦合和可忽略的超交换相互作用的情况下,温度依赖性磁化可以很好地用单离子物理来描述。此外,我们发现文献中的许多化合物也可以很好地用单离子物理来描述,我们的结果表明,在存在自旋轨道耦合的情况下,评估候选几何各向异性磁体时,考虑单离子物理是很重要的。

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