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Amination of the Gd@C82 endohedral fullerene: tunable substitution effect on quantum coherence behaviors.

Zheng LiuHuan HuangYe-Xin WangBo-Wei DongBao-Yun SunShang-Da JiangSong Gao
Published in: Chemical science (2020)
The core-shell structure of endohedral fullerene-based anisotropic magnetic molecules of high spin with long coherence time could help scale up quantum systems. In this research, by amination of Gd@C82 with morpholine, three derivatives are functionalized with 5, 7 and 9 morpholine groups providing an interesting model to investigate the relationship between the quantum coherence and the spin environment. The original radical located on the carbon cage is successfully quenched, affording a quantum phase memory times (T M) over 5 μs at 5 K. By increasing the number of substitution groups, spin-lattice relaxation times (T 1) also show significant enhancement due to the interaction variation between the molecules and the environments. We found that the T M of the three molecules show no obvious difference below 10 K, while they are limited by T 1 at higher temperatures. In this work, the variable functional groups are able to tune both T 1 and T M, offering the possibility for application of high-spin magnetic molecules in the field of quantum information processing.
Keyphrases
  • molecular dynamics
  • density functional theory
  • room temperature
  • energy transfer
  • single molecule
  • molecularly imprinted
  • monte carlo
  • transition metal
  • healthcare
  • working memory