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Effective Reconstruction of Expectation Values from Ab Initio Quantum Embedding

[Image: see text] Quantum embedding is an appealing route to fragment a large interacting quantum system into several smaller auxiliary “cluster” problems to exploit the locality of the correlated physics. In this work, we critically review approaches to recombine these fragmented solutions in order...

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Detalles Bibliográficos
Autores principales: Nusspickel, Max, Ibrahim, Basil, Booth, George H.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: American Chemical Society 2023
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10210252/
https://www.ncbi.nlm.nih.gov/pubmed/37155201
http://dx.doi.org/10.1021/acs.jctc.2c01063