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Quasiparticle Self-Consistent GW-Bethe–Salpeter Equation Calculations for Large Chromophoric Systems

[Image: see text] The GW-Bethe–Salpeter equation (BSE) method is promising for calculating the low-lying excitonic states of molecular systems. However, so far it has only been applied to rather small molecules and in the commonly implemented diagonal approximations to the electronic self-energy, it...

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Detalles Bibliográficos
Autores principales: Förster, Arno, Visscher, Lucas
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2022
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9648197/
https://www.ncbi.nlm.nih.gov/pubmed/36201788
http://dx.doi.org/10.1021/acs.jctc.2c00531