Capturing the Dynamic Correlation for Arbitrary...

Capturing the Dynamic Correlation for Arbitrary Spin-Symmetry CASSCF Reference with Adiabatic Connection Approaches: Insights into the Electronic Structure of the Tetramethyleneethane Diradical

Pastorczak, Ewa, Hapka, Michal, Veis, Libor, Pernal, Katarzyna
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Language:
english
Journal:
The Journal of Physical Chemistry Letters
DOI:
10.1021/acs.jpclett.9b01582
Date:
July, 2019
File:
PDF, 848 KB
english, 2019
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