Department of Physics and Astronomy, Uppsala University, Box 516, 751 20 Uppsala, Sweden.
J Phys Chem Lett. 2023 Jun 8;14(22):5119-5126. doi: 10.1021/acs.jpclett.3c00526. Epub 2023 May 30.
Closed shell molecular structures are under normal conditions time-reversal invariant. Experimental evidence points, however, toward that this invariance may be locally violated when the structure is in contact with a particle reservoir. The mechanisms behind such local symmetry breaking are not clear by any means. By considering a minimal model for a closed shell structure, here we propose that the symmetry breaking may result from a combination of internal and/or external interactions. It is shown that a magnetic moment of a localized electron level can be generated and maintained under the influence of such a combination. The theoretical results should cast new light on the mechanisms that may form magnetic properties in molecular compounds.
在通常情况下,满壳层分子结构具有时间反演不变性。然而,实验证据表明,当结构与粒子储库接触时,这种不变性可能会在局部被破坏。目前还没有任何方法能够清楚地解释这种局部对称性破坏的机制。通过考虑一个封闭壳层结构的最小模型,我们在这里提出,这种对称性破坏可能是由内部和/或外部相互作用的组合引起的。结果表明,在这种组合的影响下,可以产生并维持局域电子能级的磁矩。理论结果应该为可能在分子化合物中形成磁性的机制提供新的线索。