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Magnetochemistry, Volume 8, Issue 4

April 2022 - 11 articles

Cover Story: We synthesized a Co^II complex with two terpyridine ligands, one of which has a paramagnetic nitroxide group at its terminus. As Co^II is paramagnetic, we measured the distance between Co^II and nitroxide using relaxation-induced dipolar modulation enhancement (RIDME) and double-electron-electron resonance (DEER) pulse sequences at 34 GHz. Our complex’s structure can be seen on the top of the cover, with the red arrow indicating the distance between the paramagnetic centers we sought to measure. On the bottom left are the6-pulse RIDME experimental data, and on the bottom right is the Co^II–nitroxide distance of 2.6 nm found with our experiment. View this paper

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25 Citations

12,327 Views

15 Pages

EPR Spectroscopy of Cu(II) Complexes: Prediction of g-Tensors Using Double-Hybrid Density Functional Theory

Maria Drosou,
Christiana A. Mitsopoulou,
Maylis Orio and
Dimitrios A. Pantazis

Magnetochemistry2022, 8(4), 36;https://doi.org/10.3390/magnetochemistry8040036

23 March 2022

Computational electron paramagnetic resonance (EPR) spectroscopy is an important field of applied quantum chemistry that contributes greatly to connecting spectroscopic observations with the fundamental description of electronic structure for open-sh...

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Magnetochemistry - ISSN 2312-7481

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