Valence tautomeric dinuclear adducts of Co(ii) diketonates with redox-active diquinones for the design of spin qubits: computational modeling
Author:
Affiliation:
1. Institute of Physical and Organic Chemistry at Southern Federal University
2. Rostov on Don
3. Russian Federation
4. Southern Scientific Center of the Russian Academy of Sciences
Abstract
DFT calculations performed on dinuclear adducts of Co(ii) diketonates with redox-active diquinones showed that with the proper structural tuning of the ligands, these paramagnetic complexes possess the properties required in a 2-qubit molecular system.
Publisher
Royal Society of Chemistry (RSC)
Subject
Inorganic Chemistry
Link
http://pubs.rsc.org/en/content/articlepdf/2015/DT/C4DT03053B
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