Spin–Orbit Couplings of Open-Shell Systems with Restricted Active Space Configuration Interaction
Author:
Affiliation:
1. Donostia International Physics Center (DIPC), 20018Donostia, Euskadi, Spain
2. Kimika Fakultatea, Euskal Herriko Unibertsitatea (UPV/EHU), 20018Donostia, Euskadi, Spain
3. IKERBASQUE, Basque Foundation for Science, 48009Bilbao, Euskadi, Spain
Funder
Ministerio de Ciencia e Innovaci?n
Eusko Jaurlaritza
Publisher
American Chemical Society (ACS)
Subject
Physical and Theoretical Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/acs.jpca.2c08056
Reference85 articles.
1. Perspective: Relativistic effects
2. Spin-orbit coupling and intersystem crossing in molecules
3. Phosphorescence and the R⊚le of the Triplet State in the Electronic Excitation of Complex Molecules.
4. Two-Component Multireference Restricted Active Space Configuration Interaction for the Computation of L-Edge X-ray Absorption Spectra
5. Spin-forbidden chemistry within the Breit-Pauli approximation
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