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Molecular Pseudorotation in Phthalocyanines as a Tool for Magnetic Field Control at the Nanoscale
Journal of the American Chemical Society ( IF 15.0 ) Pub Date : 2024-05-14 , DOI: 10.1021/jacs.4c01915
Raphael Wilhelmer 1 , Matthias Diez 1 , Johannes K. Krondorfer 1 , Andreas W. Hauser 1
Affiliation  

Metal phthalocyanines, a highly versatile class of aromatic, planar, macrocyclic molecules with a chelated central metal ion, are topical objects of ongoing research and particularly interesting due to their magnetic properties. However, while the current focus lies almost exclusively on spin-Zeeman-related effects, the high symmetry of the molecule and its circular shape suggests the exploitation of light-induced excitation of 2-fold degenerate vibrational states in order to generate, switch, and manipulate magnetic fields at the nanoscale. The underlying mechanism is a molecular pseudorotation that can be triggered by infrared pulses and gives rise to a quantized, small, but controllable magnetic dipole moment. We investigate the optical stimulation of vibrationally induced molecular magnetism and estimate changes in the magnetic shielding constants for confirmation by future experiments.

中文翻译:


酞菁分子赝旋转作为纳米尺度磁场控制的工具



金属酞菁是一类高度通用的芳香族平面大环分子,具有螯合的中心金属离子,是正在进行的研究的热门对象,并且由于其磁性而特别令人感兴趣。然而,虽然目前的焦点几乎完全集中在自旋塞曼相关效应上,但分子的高度对称性及其圆形形状表明,利用光诱导激发 2 倍简并振动态来生成、切换和在纳米尺度上操纵磁场。其基本机制是分子赝旋转,可以由红外脉冲触发,并产生量化的、小但可控的磁偶极矩。我们研究了振动引起的分子磁性的光刺激,并估计了磁屏蔽常数的变化,以便通过未来的实验进行确认。
更新日期:2024-05-14
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