Reduced density matrix driven CASSCF corrected for dynamic...

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Journal of Chemical Theory and Computation 2020 / 06

Reduced density matrix driven CASSCF corrected for dynamic correlation from the adiabatic connection

Maradzike, Elvis, Hapka, Michal, Pernal, Katarzyna, DePrince, A. Eugene
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Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/acs.jctc.0c00324
Date:
June, 2020
File:
PDF, 439 KB
2020
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