4.6 Article

Simple screened exact-exchange approach for excitonic properties in solids

Journal

PHYSICAL REVIEW B
Volume 92, Issue 3, Pages -

Publisher

AMER PHYSICAL SOC
DOI: 10.1103/PhysRevB.92.035202

Keywords

-

Funding

  1. NSF [DMR-1408904]
  2. GENCI [0544]
  3. Division Of Materials Research
  4. Direct For Mathematical & Physical Scien [1408904] Funding Source: National Science Foundation

Ask authors/readers for more resources

We present a screened exact-exchange (SXX) method for the efficient and accurate calculation of the optical properties of solids, where the screening is achieved through the zero-wave-vector limit of the inverse dielectric function. The SXX approach can be viewed as a simplification of the Bethe-Salpeter equation (BSE) or, in the context of time-dependent density-functional theory, as a first step towards a new class of hybrid functionals for the optical properties of solids. SXX performs well for bound excitons and continuum spectra in both small-gap semiconductors and large-gap insulators, with a computational cost much lower than that of the BSE.

Authors

I am an author on this paper
Click your name to claim this paper and add it to your profile.

Reviews

Primary Rating

4.6
Not enough ratings

Secondary Ratings

Novelty
-
Significance
-
Scientific rigor
-
Rate this paper

Recommended

No Data Available
No Data Available