Accurate Magnetic Couplings in Chromium-Based Molecular Rings from Broken-Symmetry Calculations within Density Functional Theory
Author:
Affiliation:
1. Department of Materials and Interfaces, Weizmann Institute of Science, Rehovoth 76100, Israel
2. Faculty of Physics, A. Mickiewicz University, 61-614 Poznań, Poland
3. Institute of Physics, University of Zielona Góra, 65-516 Zielona Góra, Poland
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry,Computer Science Applications
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jctc.9b00459
Reference83 articles.
1. Molecular Magnets
2. Molecular magnetism, quo vadis? A historical perspective from a coordination chemist viewpoint☆
3. Molecular single-ion magnets based on lanthanides and actinides: Design considerations and new advances in the context of quantum technologies
4. Single-Molecule Nanomagnets
5. [Fe(OMe)2(O2CCH2Cl)]10, a Molecular Ferric Wheel
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