Matches in SemOpenAlex for { <https://semopenalex.org/work/W4200465002> ?p ?o ?g. }
- W4200465002 abstract "Silver chloride is a material that has been investigated and used for many decades. Of particular interest are its optical properties, but only few fundamental theoretical studies exist. We present first-principles results for the optical properties of AgCl, obtained using time-dependent density functional theory and many-body perturbation theory. We show that optical properties exhibit strong excitonic effects, which are correctly captured only by solving the Bethe-Salpeter equation starting from quasiparticle self-consistent $GW$ results. Numerical simulations are made feasible by using a model screening for the electron-hole interaction in a way that avoids the calculation of the static dielectric constant. Finally, the localization of bright and dark excitons is discussed." @default.
- W4200465002 created "2021-12-31" @default.
- W4200465002 creator A5030322812 @default.
- W4200465002 creator A5042838223 @default.
- W4200465002 creator A5044297669 @default.
- W4200465002 creator A5062832028 @default.
- W4200465002 date "2021-12-23" @default.
- W4200465002 modified "2023-10-06" @default.
- W4200465002 title "First-principles study of excitons in optical spectra of silver chloride" @default.
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