English (United Kingdom)

https://curated-unify.zendy.io/wp-json/zendy-region/v1/featured_content/oa?rat=en

https://curated-unify.zendy.io/wp-json/zendy-region/v1/highlighted_journal/

Global: Zendy Plus annual

Presents the access of premium content as premium feature

Premium Content

Presents the keyphrase highlighting as premium feature

Keyphrase Highlighting

Presents the summarisation as premium feature

Summarisation

Insights

Presents the pdf analysis as premium feature

PDF Analysis

Presents the zaia usage as premium feature

ZAIA

Global: Zendy Tools annual

Global: Zendy Free Plan

Global: Zendy Tools monthly

Global: Zendy Plus monthly

We present a theoretical framework and implementation details for self-energyembedding theory (SEET) with the GW approximation for the treatment of weaklycorrelated degrees of freedom and configuration interactions solver for handingthe strongly correlated degrees. On a series of molecular examples, for whichthe exact results are known within a given basis, we demonstrate thatSEET(CI/GW) is a systematically improvable and well controlled method capableof giving accurate results and well behaved causal self-energies and Green'sfunctions. We compare the theoretical framework of SEET(CI/GW) to that ofGW+DMFT and comment on differences between these to approaches that aim totreat both strongly and weakly correlated simultaneously.

Testing self-energy embedding theory in combination with GW